(3S)-3-formamido-4-oxidanylidene-4-phenylmethoxy-butanoic acid

Systemtic Name: (3S)-3-formamido-4-oxidanylidene-4-phenylmethoxy-butanoic acid Openeye Name: (3S)-4-benzyloxy-3-formamido-4-oxo-butanoic acid CAS Name: (3S)-3-formamido-4-oxo-4-phenylmethoxybutanoic acid IUPAC Name: (3S)-3-formamido-4-oxo-4-phenylmethoxybutanoic acid Traditional Name: (3S)-4-benzoxy-3-formamido-4-keto-butyric acid Formula: C12H13NO5 MolecularWeight: 251.23532

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H13NO5/c14-8-13-10(6-11(15)16)12(17)18-7-9-4-2-1-3-5-9/h1-5,8,10H,6-7H2,(H,13,14)(H,15,16)/t10-/m0/s1