2-[(4-methoxyphenyl)sulfonylamino]-4-oxidanylidene-4-[(phenylmethyl)amino]butanoic acid

Systemtic Name: 2-[(4-methoxyphenyl)sulfonylamino]-4-oxidanylidene-4-[(phenylmethyl)amino]butanoic acid Openeye Name: 4-(benzylamino)-2-[(4-methoxyphenyl)sulfonylamino]-4-oxo-butanoic acid CAS Name: 2-[(4-methoxyphenyl)sulfonylamino]-4-oxo-4-[(phenylmethyl)amino]butanoic acid IUPAC Name: 4-(benzylamino)-2-[(4-methoxyphenyl)sulfonylamino]-4-oxobutanoic acid Traditional Name: 4-(benzylamino)-4-keto-2-[(4-methoxyphenyl)sulfonylamino]butyric acid Formula: C18H20N2O6S MolecularWeight: 392.4262

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)NC(CC(=O)NCC2=CC=CC=C2)C(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)NC(CC(=O)NCC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C18H20N2O6S/c1-26-14-7-9-15(10-8-14)27(24,25)20-16(18(22)23)11-17(21)19-12-13-5-3-2-4-6-13/h2-10,16,20H,11-12H2,1H3,(H,19,21)(H,22,23)