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Substance Name: 1,1',1'',1'''-(Methylenebis(p-phenylenenitrilo))tetrakis(3-(4-(1-methyl-1-(4-(oxiranylmethoxy)phenyl)ethyl)phenoxy)propan-2-ol)
RN: 97552-64-2
InChIKey: WIMBSVAMVGTRRO-UHFFFAOYSA-N

Molecular Formula

  • C97-H110-N2-O16

Molecular Weight

  • 1559.934
 
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Names and Synonyms

Synonym

  • EINECS 307-117-9

Systematic Name

  • 1,1',1'',1'''-(Methylenebis(p-phenylenenitrilo))tetrakis(3-(4-(1-methyl-1-(4-(oxiranylmethoxy)phenyl)ethyl)phenoxy)propan-2-ol)

Registry Numbers

CAS Registry Number

  • 97552-64-2

System Generated Number

  • 0097552642

Structure Descriptors

InChI

1S/C97H110N2O16/c1-94(2,72-21-41-86(42-22-72)108-58-90-62-112-90)68-13-33-82(34-14-68)104-54-78(100)50-98(51-79(101)55-105-83-35-15-69(16-36-83)95(3,4)73-23-43-87(44-24-73)109-59-91-63-113-91)76-29-9-66(10-30-76)49-67-11-31-77(32-12-67)99(52-80(102)56-106-84-37-17-70(18-38-84)96(5,6)74-25-45-88(46-26-74)110-60-92-64-114-92)53-81(103)57-107-85-39-19-71(20-40-85)97(7,8)75-27-47-89(48-28-75)111-61-93-65-115-93/h9-48,78-81,90-93,100-103H,49-65H2,1-8H3

InChIKey

WIMBSVAMVGTRRO-UHFFFAOYSA-N

Smiles

O1C(C1)COc1ccc(C(c2ccc(OCC(CN(c3ccc(Cc4ccc(N(CC(COc5ccc(C(c6ccc(OCC7OC7)cc6)(C)C)cc5)O)CC(COc5ccc(C(c6ccc(OCC7OC7)cc6)(C)C)cc5)O)cc4)cc3)CC(COc3ccc(C(c4ccc(OCC5OC5)cc4)(C)C)cc3)O)O)cc2)(C)C)cc1