N-[3-[(6E)-2-azanyl-3-cyano-6-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)-1H-pyridin-4-yl]phenyl]-2-methoxy-ethanamide

Systemtic Name: N-[3-[(6E)-2-azanyl-3-cyano-6-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)-1H-pyridin-4-yl]phenyl]-2-methoxy-ethanamide Openeye Name: N-[3-[(6E)-2-amino-3-cyano-6-(6-oxocyclohexa-2,4-dien-1-ylidene)-1H-pyridin-4-yl]phenyl]-2-methoxy-acetamide CAS Name: N-[3-[(6E)-2-amino-3-cyano-6-(6-oxo-1-cyclohexa-2,4-dienylidene)-1H-pyridin-4-yl]phenyl]-2-methoxyacetamide IUPAC Name: N-[3-[(6E)-2-amino-3-cyano-6-(6-oxocyclohexa-2,4-dien-1-ylidene)-1H-pyridin-4-yl]phenyl]-2-methoxyacetamide Traditional Name: N-[3-[(6E)-2-amino-3-cyano-6-(6-ketocyclohexa-2,4-dien-1-ylidene)-1H-pyridin-4-yl]phenyl]-2-methoxy-acetamide Formula: C21H18N4O3 MolecularWeight: 374.39262

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Descriptors Computed from Structure

Canonical SMILES:

COCC(=O)NC1=CC=CC(=C1)C2=CC(=C3C=CC=CC3=O)NC(=C2C#N)N

Isomeric SMILES

COCC(=O)NC1=CC=CC(=C1)C2=C/C(=C\3/C=CC=CC3=O)/NC(=C2C#N)N

InChI

InChI=1S/C21H18N4O3/c1-28-12-20(27)24-14-6-4-5-13(9-14)16-10-18(25-21(23)17(16)11-22)15-7-2-3-8-19(15)26/h2-10,25H,12,23H2,1H3,(H,24,27)/b18-15+