5-[[(Z)-[(3-methoxy-4-octoxy-phenyl)-phenyl-methylidene]amino]sulfamoyl]benzene-1,3-dicarboxylic acid

Systemtic Name: 5-[[(Z)-[(3-methoxy-4-octoxy-phenyl)-phenyl-methylidene]amino]sulfamoyl]benzene-1,3-dicarboxylic acid Openeye Name: 5-[[(Z)-[(3-methoxy-4-octoxy-phenyl)-phenyl-methylene]amino]sulfamoyl]benzene-1,3-dicarboxylic acid CAS Name: 5-[[(Z)-[(3-methoxy-4-octoxyphenyl)-phenylmethylidene]amino]sulfamoyl]benzene-1,3-dicarboxylic acid IUPAC Name: 5-[[(Z)-[(3-methoxy-4-octoxyphenyl)-phenylmethylidene]amino]sulfamoyl]benzene-1,3-dicarboxylic acid Traditional Name: 5-[[(Z)-[(3-methoxy-4-octoxy-phenyl)-phenyl-methylene]amino]sulfamoyl]isophthalic acid Formula: C30H34N2O8S MolecularWeight: 582.66456

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=C(C=C(C=C1)C(=NNS(=O)(=O)C2=CC(=CC(=C2)C(=O)O)C(=O)O)C3=CC=CC=C3)OC

Isomeric SMILES

CCCCCCCCOC1=C(C=C(C=C1)/C(=N\NS(=O)(=O)C2=CC(=CC(=C2)C(=O)O)C(=O)O)/C3=CC=CC=C3)OC

InChI

InChI=1S/C30H34N2O8S/c1-3-4-5-6-7-11-16-40-26-15-14-22(20-27(26)39-2)28(21-12-9-8-10-13-21)31-32-41(37,38)25-18-23(29(33)34)17-24(19-25)30(35)36/h8-10,12-15,17-20,32H,3-7,11,16H2,1-2H3,(H,33,34)(H,35,36)/b31-28-