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

Systemtic Name: 4-[(2,4-dichlorophenyl)amino]-4-oxidanylidene-2-[(phenylmethyl)amino]butanoic acid Openeye Name: 2-(benzylamino)-4-(2,4-dichloroanilino)-4-oxo-butanoic acid CAS Name: 4-(2,4-dichloroanilino)-4-oxo-2-[(phenylmethyl)amino]butanoic acid IUPAC Name: 2-(benzylamino)-4-(2,4-dichloroanilino)-4-oxobutanoic acid Traditional Name: 2-(benzylamino)-4-(2,4-dichloroanilino)-4-keto-butyric acid Formula: C17H16Cl2N2O3 MolecularWeight: 367.22654

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(CC(=O)NC2=C(C=C(C=C2)Cl)Cl)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CNC(CC(=O)NC2=C(C=C(C=C2)Cl)Cl)C(=O)O

InChI

InChI=1S/C17H16Cl2N2O3/c18-12-6-7-14(13(19)8-12)21-16(22)9-15(17(23)24)20-10-11-4-2-1-3-5-11/h1-8,15,20H,9-10H2,(H,21,22)(H,23,24)