3-[[(Z)-[(4-hexadecoxyphenyl)-phenyl-methylidene]amino]sulfamoyl]-5-methoxycarbonyl-benzoic acid

Systemtic Name: 3-[[(Z)-[(4-hexadecoxyphenyl)-phenyl-methylidene]amino]sulfamoyl]-5-methoxycarbonyl-benzoic acid Openeye Name: 3-[[(Z)-[(4-hexadecoxyphenyl)-phenyl-methylene]amino]sulfamoyl]-5-methoxycarbonyl-benzoic acid CAS Name: 3-[[(Z)-[(4-hexadecoxyphenyl)-phenylmethylidene]amino]sulfamoyl]-5-methoxycarbonylbenzoic acid IUPAC Name: 3-[[(Z)-[(4-hexadecoxyphenyl)-phenylmethylidene]amino]sulfamoyl]-5-methoxycarbonylbenzoic acid Traditional Name: 3-carbomethoxy-5-[[(Z)-[(4-cetyloxyphenyl)-phenyl-methylene]amino]sulfamoyl]benzoic acid Formula: C38H50N2O7S MolecularWeight: 678.8778

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOC1=CC=C(C=C1)C(=NNS(=O)(=O)C2=CC(=CC(=C2)C(=O)OC)C(=O)O)C3=CC=CC=C3

Isomeric SMILES

CCCCCCCCCCCCCCCCOC1=CC=C(C=C1)/C(=N\NS(=O)(=O)C2=CC(=CC(=C2)C(=O)OC)C(=O)O)/C3=CC=CC=C3

InChI

InChI=1S/C38H50N2O7S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-19-26-47-34-24-22-31(23-25-34)36(30-20-17-16-18-21-30)39-40-48(44,45)35-28-32(37(41)42)27-33(29-35)38(43)46-2/h16-18,20-25,27-29,40H,3-15,19,26H2,1-2H3,(H,41,42)/b39-36-