methyl 3-[(3-cyanophenyl)amino]butanoate

Systemtic Name: methyl 3-[(3-cyanophenyl)amino]butanoate Openeye Name: methyl 3-(3-cyanoanilino)butanoate CAS Name: 3-(3-cyanoanilino)butanoic acid methyl ester IUPAC Name: methyl 3-(3-cyanoanilino)butanoate Traditional Name: 3-(3-cyanoanilino)butyric acid methyl ester Formula: C12H14N2O2 MolecularWeight: 218.25176

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)OC)NC1=CC=CC(=C1)C#N

Isomeric SMILES

CC(CC(=O)OC)NC1=CC=CC(=C1)C#N

InChI

InChI=1S/C12H14N2O2/c1-9(6-12(15)16-2)14-11-5-3-4-10(7-11)8-13/h3-5,7,9,14H,6H2,1-2H3