(2R)-2-[(4-chlorophenyl)methyl]-4-[(4-nitrophenyl)amino]-4-oxidanylidene-butanoate

Systemtic Name: (2R)-2-[(4-chlorophenyl)methyl]-4-[(4-nitrophenyl)amino]-4-oxidanylidene-butanoate Openeye Name: (2R)-2-[(4-chlorophenyl)methyl]-4-(4-nitroanilino)-4-oxo-butanoate CAS Name: (2R)-2-[(4-chlorophenyl)methyl]-4-(4-nitroanilino)-4-oxobutanoate IUPAC Name: (2R)-2-[(4-chlorophenyl)methyl]-4-(4-nitroanilino)-4-oxobutanoate Traditional Name: (2R)-2-(4-chlorobenzyl)-4-keto-4-(4-nitroanilino)butyrate Formula: C17H14ClN2O5- MolecularWeight: 361.75646

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC(CC(=O)NC2=CC=C(C=C2)[N+](=O)[O-])C(=O)[O-])Cl

Isomeric SMILES

C1=CC(=CC=C1C[C@H](CC(=O)NC2=CC=C(C=C2)[N+](=O)[O-])C(=O)[O-])Cl

InChI

InChI=1S/C17H15ClN2O5/c18-13-3-1-11(2-4-13)9-12(17(22)23)10-16(21)19-14-5-7-15(8-6-14)20(24)25/h1-8,12H,9-10H2,(H,19,21)(H,22,23)/p-1/t12-/m1/s1