methyl 3-[[(E)-[(4-hexadecoxy-3-methoxy-phenyl)-phenyl-methylidene]amino]sulfamoyl]benzoate

Systemtic Name: methyl 3-[[(E)-[(4-hexadecoxy-3-methoxy-phenyl)-phenyl-methylidene]amino]sulfamoyl]benzoate Openeye Name: methyl 3-[[(E)-[(4-hexadecoxy-3-methoxy-phenyl)-phenyl-methylene]amino]sulfamoyl]benzoate CAS Name: 3-[[(E)-[(4-hexadecoxy-3-methoxyphenyl)-phenylmethylidene]amino]sulfamoyl]benzoic acid methyl ester IUPAC Name: methyl 3-[[(E)-[(4-hexadecoxy-3-methoxyphenyl)-phenylmethylidene]amino]sulfamoyl]benzoate Traditional Name: 3-[[(E)-[(4-cetyloxy-3-methoxy-phenyl)-phenyl-methylene]amino]sulfamoyl]benzoic acid methyl ester Formula: C38H52N2O6S MolecularWeight: 664.89428

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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)OC)C3=CC=CC=C3)OC

Isomeric SMILES

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

InChI

InChI=1S/C38H52N2O6S/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-20-28-46-35-27-26-32(30-36(35)44-2)37(31-22-18-17-19-23-31)39-40-47(42,43)34-25-21-24-33(29-34)38(41)45-3/h17-19,21-27,29-30,40H,4-16,20,28H2,1-3H3/b39-37+