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

Systemtic Name: 4-oxidanylidene-2-[(phenylmethyl)amino]-4-[(4-sulfamoylphenyl)amino]butanoic acid Openeye Name: 2-(benzylamino)-4-oxo-4-(4-sulfamoylanilino)butanoic acid CAS Name: 4-oxo-2-[(phenylmethyl)amino]-4-(4-sulfamoylanilino)butanoic acid IUPAC Name: 2-(benzylamino)-4-oxo-4-(4-sulfamoylanilino)butanoic acid Traditional Name: 2-(benzylamino)-4-keto-4-(4-sulfamoylanilino)butyric acid Formula: C17H19N3O5S MolecularWeight: 377.41486

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(CC(=O)NC2=CC=C(C=C2)S(=O)(=O)N)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CNC(CC(=O)NC2=CC=C(C=C2)S(=O)(=O)N)C(=O)O

InChI

InChI=1S/C17H19N3O5S/c18-26(24,25)14-8-6-13(7-9-14)20-16(21)10-15(17(22)23)19-11-12-4-2-1-3-5-12/h1-9,15,19H,10-11H2,(H,20,21)(H,22,23)(H2,18,24,25)