4-[(3-cyanophenyl)-methanoyl-amino]butanoic acid

Systemtic Name: 4-[(3-cyanophenyl)-methanoyl-amino]butanoic acid Openeye Name: 4-(3-cyano-N-formyl-anilino)butanoic acid CAS Name: 4-(3-cyano-N-formylanilino)butanoic acid IUPAC Name: 4-(3-cyano-N-formylanilino)butanoic acid Traditional Name: 4-(3-cyano-N-formyl-anilino)butyric acid Formula: C12H12N2O3 MolecularWeight: 232.23528

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H12N2O3/c13-8-10-3-1-4-11(7-10)14(9-15)6-2-5-12(16)17/h1,3-4,7,9H,2,5-6H2,(H,16,17)