(2S)-2-[(3-cyanophenyl)carbonylamino]-3-oxidanyl-propanoate

Systemtic Name: (2S)-2-[(3-cyanophenyl)carbonylamino]-3-oxidanyl-propanoate Openeye Name: (2S)-2-[(3-cyanobenzoyl)amino]-3-hydroxy-propanoate CAS Name: (2S)-2-[[(3-cyanophenyl)-oxomethyl]amino]-3-hydroxypropanoate IUPAC Name: (2S)-2-[(3-cyanobenzoyl)amino]-3-hydroxypropanoate Traditional Name: (2S)-2-[(3-cyanobenzoyl)amino]-3-hydroxy-propionate Formula: C11H9N2O4- MolecularWeight: 233.20016

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C(=O)NC(CO)C(=O)[O-])C#N

Isomeric SMILES

C1=CC(=CC(=C1)C(=O)N[C@@H](CO)C(=O)[O-])C#N

InChI

InChI=1S/C11H10N2O4/c12-5-7-2-1-3-8(4-7)10(15)13-9(6-14)11(16)17/h1-4,9,14H,6H2,(H,13,15)(H,16,17)/p-1/t9-/m0/s1