(2S)-4-(4-chlorophenyl)-2-[(4-chlorophenyl)methylazaniumyl]-4-oxidanylidene-butanoate

Systemtic Name: (2S)-4-(4-chlorophenyl)-2-[(4-chlorophenyl)methylazaniumyl]-4-oxidanylidene-butanoate Openeye Name: (2S)-4-(4-chlorophenyl)-2-[(4-chlorophenyl)methylammonio]-4-oxo-butanoate CAS Name: (2S)-4-(4-chlorophenyl)-2-[(4-chlorophenyl)methylammonio]-4-oxobutanoate IUPAC Name: (2S)-4-(4-chlorophenyl)-2-[(4-chlorophenyl)methylazaniumyl]-4-oxobutanoate Traditional Name: (2S)-2-[(4-chlorobenzyl)ammonio]-4-(4-chlorophenyl)-4-keto-butyrate Formula: C17H15Cl2NO3 MolecularWeight: 352.2119

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C[NH2+]C(CC(=O)C2=CC=C(C=C2)Cl)C(=O)[O-])Cl

Isomeric SMILES

C1=CC(=CC=C1C[NH2+][C@@H](CC(=O)C2=CC=C(C=C2)Cl)C(=O)[O-])Cl

InChI

InChI=1S/C17H15Cl2NO3/c18-13-5-1-11(2-6-13)10-20-15(17(22)23)9-16(21)12-3-7-14(19)8-4-12/h1-8,15,20H,9-10H2,(H,22,23)/t15-/m0/s1