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Substance Name: N-Benzyl-5,10,15,20-tetrakis(4-carboxyphenyl)porphine
RN: 108440-59-1
InChIKey: TYKXQJUSHZBYAO-QMTQPZJVSA-N

Molecular Formula

  • C55-H36-N4-O8

Molecular Weight

  • 880.909
 
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Names and Synonyms

Name of Substance

  • N-Benzyl-5,10,15,20-tetrakis(4-carboxyphenyl)porphine

Synonym

  • N-Bzhtcpp

Systematic Name

  • Benzoic acid, 4,4',4'',4'''-(21-(phenylmethyl)-21H,23H-porphine-5,10,15,20-tetrayl)tetrakis-

Registry Numbers

CAS Registry Number

  • 108440-59-1

System Generated Number

  • 0108440591

Structure Descriptors

InChI

1S/C55H36N4O8/c60-52(61)36-14-6-32(7-15-36)48-40-22-23-41(56-40)49(33-8-16-37(17-9-33)53(62)63)43-25-27-45(58-43)51(35-12-20-39(21-13-35)55(66)67)47-29-28-46(59(47)30-31-4-2-1-3-5-31)50(44-26-24-42(48)57-44)34-10-18-38(19-11-34)54(64)65/h1-29,56H,30H2,(H,60,61)(H,62,63)(H,64,65)(H,66,67)/b48-40-,48-42-,49-41-,49-43-,50-44-,50-46-,51-45-,51-47-

InChIKey

TYKXQJUSHZBYAO-QMTQPZJVSA-N

Smiles

c1(ccc(C(O)=O)cc1)c1c2ccc(n2Cc2ccccc2)c(c2C=Cc(n2)c(c2[nH]c(c(c3C=Cc1n3)c1ccc(cc1)C(O)=O)cc2)c1ccc(cc1)C(O)=O)c1ccc(cc1)C(O)=O