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Substance Name: Spiro(isobenzofuran-1(3H),9'-(9H)xanthen)-3-one, 6'-(dipentylamino)-3'-methyl-2'-(phenylamino)-
RN: 129473-78-5
InChIKey: SHHQYIMTQGDRHS-UHFFFAOYSA-N

Classification Code

  • TSCA Flag PMN (a Commenced PMN (Premanufacture Notice) Substance)

Molecular Formula

  • C37-H40-N2-O3

Molecular Weight

  • 560.734
 
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Names and Synonyms

Synonym

  • 6'-(Dipentylamino)-3'-methyl-2'-(phenylamino)spiro(isobenzofuran-1(3H)-9'-(9H)xanthen)-3-one

Systematic Name

  • Spiro(isobenzofuran-1(3H),9'-(9H)xanthen)-3-one, 6'-(dipentylamino)-3'-methyl-2'-(phenylamino)-

Registry Numbers

CAS Registry Number

  • 129473-78-5

Other Registry Number

  • 207748-52-5

System Generated Number

  • 0129473785

Structure Descriptors

InChI

1S/C37H40N2O3/c1-4-6-13-21-39(22-14-7-5-2)28-19-20-31-35(24-28)41-34-23-26(3)33(38-27-15-9-8-10-16-27)25-32(34)37(31)30-18-12-11-17-29(30)36(40)42-37/h8-12,15-20,23-25,38H,4-7,13-14,21-22H2,1-3H3

InChIKey

SHHQYIMTQGDRHS-UHFFFAOYSA-N

Smiles

c12[C@@]3(OC(=O)c4c3cccc4)c3c(Oc1cc(c(c2)Nc1ccccc1)C)cc(cc3)N(CCCCC)CCCCC