(3S)-4-oxidanylidene-4-phenoxy-3-(phenylmethoxycarbonylamino)butanoate

Systemtic Name: (3S)-4-oxidanylidene-4-phenoxy-3-(phenylmethoxycarbonylamino)butanoate Openeye Name: (3S)-3-(benzyloxycarbonylamino)-4-oxo-4-phenoxy-butanoate CAS Name: (3S)-4-oxo-4-phenoxy-3-(phenylmethoxycarbonylamino)butanoate IUPAC Name: (3S)-4-oxo-4-phenoxy-3-(phenylmethoxycarbonylamino)butanoate Traditional Name: (3S)-3-(benzyloxycarbonylamino)-4-keto-4-phenoxy-butyrate Formula: C18H16NO6- MolecularWeight: 342.32274

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NC(CC(=O)[O-])C(=O)OC2=CC=CC=C2

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)N[C@@H](CC(=O)[O-])C(=O)OC2=CC=CC=C2

InChI

InChI=1S/C18H17NO6/c20-16(21)11-15(17(22)25-14-9-5-2-6-10-14)19-18(23)24-12-13-7-3-1-4-8-13/h1-10,15H,11-12H2,(H,19,23)(H,20,21)/p-1/t15-/m0/s1