(3S)-4-azanyl-4-oxidanylidene-3-(phenylmethoxycarbonylamino)butanoic acid

Systemtic Name: (3S)-4-azanyl-4-oxidanylidene-3-(phenylmethoxycarbonylamino)butanoic acid Openeye Name: (3S)-4-amino-3-(benzyloxycarbonylamino)-4-oxo-butanoic acid CAS Name: (3S)-4-amino-4-oxo-3-(phenylmethoxycarbonylamino)butanoic acid IUPAC Name: (3S)-4-amino-4-oxo-3-(phenylmethoxycarbonylamino)butanoic acid Traditional Name: (3S)-4-amino-3-(benzyloxycarbonylamino)-4-keto-butyric acid Formula: C12H14N2O5 MolecularWeight: 266.24996

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NC(CC(=O)O)C(=O)N

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)N[C@@H](CC(=O)O)C(=O)N

InChI

InChI=1S/C12H14N2O5/c13-11(17)9(6-10(15)16)14-12(18)19-7-8-4-2-1-3-5-8/h1-5,9H,6-7H2,(H2,13,17)(H,14,18)(H,15,16)/t9-/m0/s1