4-azanylidene-3-[(4-cyanophenyl)methyl]butanoic acid

Systemtic Name: 4-azanylidene-3-[(4-cyanophenyl)methyl]butanoic acid Openeye Name: 3-[(4-cyanophenyl)methyl]-4-imino-butanoic acid CAS Name: 3-[(4-cyanophenyl)methyl]-4-iminobutanoic acid IUPAC Name: 3-[(4-cyanophenyl)methyl]-4-iminobutanoic acid Traditional Name: 3-(4-cyanobenzyl)-4-imino-butyric acid Formula: C12H12N2O2 MolecularWeight: 216.23588

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC(CC(=O)O)C=N)C#N

Isomeric SMILES

C1=CC(=CC=C1CC(CC(=O)O)C=N)C#N

InChI

InChI=1S/C12H12N2O2/c13-7-10-3-1-9(2-4-10)5-11(8-14)6-12(15)16/h1-4,8,11,14H,5-6H2,(H,15,16)