2-(3-cyanopropanoylamino)-3-phenyl-propanoic acid

Systemtic Name: 2-(3-cyanopropanoylamino)-3-phenyl-propanoic acid Openeye Name: 2-(3-cyanopropanoylamino)-3-phenyl-propanoic acid CAS Name: 2-[(3-cyano-1-oxopropyl)amino]-3-phenylpropanoic acid IUPAC Name: 2-(3-cyanopropanoylamino)-3-phenylpropanoic acid Traditional Name: 2-(3-cyanopropanoylamino)-3-phenyl-propionic acid Formula: C13H14N2O3 MolecularWeight: 246.26186

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H14N2O3/c14-8-4-7-12(16)15-11(13(17)18)9-10-5-2-1-3-6-10/h1-3,5-6,11H,4,7,9H2,(H,15,16)(H,17,18)