3-phenylpropyl 5-[[4-[(4-ethoxyphenyl)sulfamoyl]phenyl]amino]-5-oxidanylidene-pentanoate

Systemtic Name: 3-phenylpropyl 5-[[4-[(4-ethoxyphenyl)sulfamoyl]phenyl]amino]-5-oxidanylidene-pentanoate Openeye Name: 3-phenylpropyl 5-[4-[(4-ethoxyphenyl)sulfamoyl]anilino]-5-oxo-pentanoate CAS Name: 5-[4-[(4-ethoxyphenyl)sulfamoyl]anilino]-5-oxopentanoic acid 3-phenylpropyl ester IUPAC Name: 3-phenylpropyl 5-[4-[(4-ethoxyphenyl)sulfamoyl]anilino]-5-oxopentanoate Traditional Name: 5-keto-5-[4-(p-phenetylsulfamoyl)anilino]valeric acid 3-phenylpropyl ester Formula: C28H32N2O6S MolecularWeight: 524.62848

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)CCCC(=O)OCCCC3=CC=CC=C3

Isomeric SMILES

CCOC1=CC=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)CCCC(=O)OCCCC3=CC=CC=C3

InChI

InChI=1S/C28H32N2O6S/c1-2-35-25-17-13-24(14-18-25)30-37(33,34)26-19-15-23(16-20-26)29-27(31)11-6-12-28(32)36-21-7-10-22-8-4-3-5-9-22/h3-5,8-9,13-20,30H,2,6-7,10-12,21H2,1H3,(H,29,31)