(3S)-3-acetyloxy-4-[(4-chlorophenyl)methylamino]-4-oxidanylidene-butanoic acid

Systemtic Name: (3S)-3-acetyloxy-4-[(4-chlorophenyl)methylamino]-4-oxidanylidene-butanoic acid Openeye Name: (3S)-3-acetoxy-4-[(4-chlorophenyl)methylamino]-4-oxo-butanoic acid CAS Name: (3S)-3-acetyloxy-4-[(4-chlorophenyl)methylamino]-4-oxobutanoic acid IUPAC Name: (3S)-3-acetyloxy-4-[(4-chlorophenyl)methylamino]-4-oxobutanoic acid Traditional Name: (3S)-3-acetoxy-4-[(4-chlorobenzyl)amino]-4-keto-butyric acid Formula: C13H14ClNO5 MolecularWeight: 299.70696

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC(CC(=O)O)C(=O)NCC1=CC=C(C=C1)Cl

Isomeric SMILES

CC(=O)O[C@@H](CC(=O)O)C(=O)NCC1=CC=C(C=C1)Cl

InChI

InChI=1S/C13H14ClNO5/c1-8(16)20-11(6-12(17)18)13(19)15-7-9-2-4-10(14)5-3-9/h2-5,11H,6-7H2,1H3,(H,15,19)(H,17,18)/t11-/m0/s1