(2S)-2-benzamido-3-(3-methoxy-2-oxidanyl-phenyl)propanoate

Systemtic Name: (2S)-2-benzamido-3-(3-methoxy-2-oxidanyl-phenyl)propanoate Openeye Name: (2S)-2-benzamido-3-(2-hydroxy-3-methoxy-phenyl)propanoate CAS Name: (2S)-2-benzamido-3-(2-hydroxy-3-methoxyphenyl)propanoate IUPAC Name: (2S)-2-benzamido-3-(2-hydroxy-3-methoxyphenyl)propanoate Traditional Name: (2S)-2-benzamido-3-(2-hydroxy-3-methoxy-phenyl)propionate Formula: C17H16NO5- MolecularWeight: 314.31264

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1O)CC(C(=O)[O-])NC(=O)C2=CC=CC=C2

Isomeric SMILES

COC1=CC=CC(=C1O)C[C@@H](C(=O)[O-])NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C17H17NO5/c1-23-14-9-5-8-12(15(14)19)10-13(17(21)22)18-16(20)11-6-3-2-4-7-11/h2-9,13,19H,10H2,1H3,(H,18,20)(H,21,22)/p-1/t13-/m0/s1