2-[(3-cyanophenyl)carbonylamino]-3-oxidanyl-butanoic acid

Systemtic Name: 2-[(3-cyanophenyl)carbonylamino]-3-oxidanyl-butanoic acid Openeye Name: 2-[(3-cyanobenzoyl)amino]-3-hydroxy-butanoic acid CAS Name: 2-[[(3-cyanophenyl)-oxomethyl]amino]-3-hydroxybutanoic acid IUPAC Name: 2-[(3-cyanobenzoyl)amino]-3-hydroxybutanoic acid Traditional Name: 2-[(3-cyanobenzoyl)amino]-3-hydroxy-butyric acid Formula: C12H12N2O4 MolecularWeight: 248.23468

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H12N2O4/c1-7(15)10(12(17)18)14-11(16)9-4-2-3-8(5-9)6-13/h2-5,7,10,15H,1H3,(H,14,16)(H,17,18)