4-[(Z)-3-azanyl-2-cyano-3-oxidanylidene-prop-1-enyl]benzoic acid

Systemtic Name: 4-[(Z)-3-azanyl-2-cyano-3-oxidanylidene-prop-1-enyl]benzoic acid Openeye Name: 4-[(Z)-3-amino-2-cyano-3-oxo-prop-1-enyl]benzoic acid CAS Name: 4-[(Z)-3-amino-2-cyano-3-oxoprop-1-enyl]benzoic acid IUPAC Name: 4-[(Z)-3-amino-2-cyano-3-oxoprop-1-enyl]benzoic acid Traditional Name: 4-[(Z)-3-amino-2-cyano-3-keto-prop-1-enyl]benzoic acid Formula: C11H8N2O3 MolecularWeight: 216.19282

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C1=CC(=CC=C1/C=C(/C#N)\C(=O)N)C(=O)O

InChI

InChI=1S/C11H8N2O3/c12-6-9(10(13)14)5-7-1-3-8(4-2-7)11(15)16/h1-5H,(H2,13,14)(H,15,16)/b9-5-