methyl 2-[(5-cyano-3,4-dimethyl-6-oxidanylidene-pyridazin-1-yl)methyl]-4-phenyl-quinoline-3-carboxylate

Systemtic Name: methyl 2-[(5-cyano-3,4-dimethyl-6-oxidanylidene-pyridazin-1-yl)methyl]-4-phenyl-quinoline-3-carboxylate Openeye Name: methyl 2-[(5-cyano-3,4-dimethyl-6-oxo-pyridazin-1-yl)methyl]-4-phenyl-quinoline-3-carboxylate CAS Name: 2-[(5-cyano-3,4-dimethyl-6-oxo-1-pyridazinyl)methyl]-4-phenyl-3-quinolinecarboxylic acid methyl ester IUPAC Name: methyl 2-[(5-cyano-3,4-dimethyl-6-oxopyridazin-1-yl)methyl]-4-phenylquinoline-3-carboxylate Traditional Name: 2-[(5-cyano-6-keto-3,4-dimethyl-pyridazin-1-yl)methyl]-4-phenyl-quinoline-3-carboxylic acid methyl ester Formula: C25H20N4O3 MolecularWeight: 424.4513

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N=C1C)CC2=NC3=CC=CC=C3C(=C2C(=O)OC)C4=CC=CC=C4)C#N

Isomeric SMILES

CC1=C(C(=O)N(N=C1C)CC2=NC3=CC=CC=C3C(=C2C(=O)OC)C4=CC=CC=C4)C#N

InChI

InChI=1S/C25H20N4O3/c1-15-16(2)28-29(24(30)19(15)13-26)14-21-23(25(31)32-3)22(17-9-5-4-6-10-17)18-11-7-8-12-20(18)27-21/h4-12H,14H2,1-3H3