cyanomethyl 3-benzamidobutanoate

Systemtic Name: cyanomethyl 3-benzamidobutanoate Openeye Name: cyanomethyl 3-benzamidobutanoate CAS Name: 3-benzamidobutanoic acid cyanomethyl ester IUPAC Name: cyanomethyl 3-benzamidobutanoate Traditional Name: 3-benzamidobutyric acid cyanomethyl ester Formula: C13H14N2O3 MolecularWeight: 246.26186

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H14N2O3/c1-10(9-12(16)18-8-7-14)15-13(17)11-5-3-2-4-6-11/h2-6,10H,8-9H2,1H3,(H,15,17)