methyl 3-(3-cyano-2-methoxy-6-phenyl-pyridin-4-yl)azulene-1-carboxylate

Systemtic Name: methyl 3-(3-cyano-2-methoxy-6-phenyl-pyridin-4-yl)azulene-1-carboxylate Openeye Name: methyl 3-(3-cyano-2-methoxy-6-phenyl-4-pyridyl)azulene-1-carboxylate CAS Name: 3-(3-cyano-2-methoxy-6-phenyl-4-pyridinyl)-1-azulenecarboxylic acid methyl ester IUPAC Name: methyl 3-(3-cyano-2-methoxy-6-phenylpyridin-4-yl)azulene-1-carboxylate Traditional Name: 3-(3-cyano-2-methoxy-6-phenyl-4-pyridyl)azulene-1-carboxylic acid methyl ester Formula: C25H18N2O3 MolecularWeight: 394.42202

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=N1)C2=CC=CC=C2)C3=CC(=C4C3=CC=CC=C4)C(=O)OC)C#N

Isomeric SMILES

COC1=C(C(=CC(=N1)C2=CC=CC=C2)C3=CC(=C4C3=CC=CC=C4)C(=O)OC)C#N

InChI

InChI=1S/C25H18N2O3/c1-29-24-22(15-26)20(14-23(27-24)16-9-5-3-6-10-16)19-13-21(25(28)30-2)18-12-8-4-7-11-17(18)19/h3-14H,1-2H3