4-(3-azanyl-4-cyano-phenyl)-4-oxidanylidene-butanoic acid

Systemtic Name: 4-(3-azanyl-4-cyano-phenyl)-4-oxidanylidene-butanoic acid Openeye Name: 4-(3-amino-4-cyano-phenyl)-4-oxo-butanoic acid CAS Name: 4-(3-amino-4-cyanophenyl)-4-oxobutanoic acid IUPAC Name: 4-(3-amino-4-cyanophenyl)-4-oxobutanoic acid Traditional Name: 4-(3-amino-4-cyano-phenyl)-4-keto-butyric acid Formula: C11H10N2O3 MolecularWeight: 218.2087

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(=O)CCC(=O)O)N)C#N

Isomeric SMILES

C1=CC(=C(C=C1C(=O)CCC(=O)O)N)C#N

InChI

InChI=1S/C11H10N2O3/c12-6-8-2-1-7(5-9(8)13)10(14)3-4-11(15)16/h1-2,5H,3-4,13H2,(H,15,16)