3-[[(Z)-[(4-hexadecoxy-3-methoxy-phenyl)-phenyl-methylidene]amino]sulfamoyl]benzoic acid

Systemtic Name: 3-[[(Z)-[(4-hexadecoxy-3-methoxy-phenyl)-phenyl-methylidene]amino]sulfamoyl]benzoic acid Openeye Name: 3-[[(Z)-[(4-hexadecoxy-3-methoxy-phenyl)-phenyl-methylene]amino]sulfamoyl]benzoic acid CAS Name: 3-[[(Z)-[(4-hexadecoxy-3-methoxyphenyl)-phenylmethylidene]amino]sulfamoyl]benzoic acid IUPAC Name: 3-[[(Z)-[(4-hexadecoxy-3-methoxyphenyl)-phenylmethylidene]amino]sulfamoyl]benzoic acid Traditional Name: 3-[[(Z)-[(4-cetyloxy-3-methoxy-phenyl)-phenyl-methylene]amino]sulfamoyl]benzoic acid Formula: C37H50N2O6S MolecularWeight: 650.8677

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C37H50N2O6S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-19-27-45-34-26-25-31(29-35(34)44-2)36(30-21-17-16-18-22-30)38-39-46(42,43)33-24-20-23-32(28-33)37(40)41/h16-18,20-26,28-29,39H,3-15,19,27H2,1-2H3,(H,40,41)/b38-36-