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

Systemtic Name: methyl 2-[(5-cyano-3,4-dimethyl-6-oxidanylidene-pyridazin-1-yl)methyl]-4-methyl-quinoline-3-carboxylate Openeye Name: methyl 2-[(5-cyano-3,4-dimethyl-6-oxo-pyridazin-1-yl)methyl]-4-methyl-quinoline-3-carboxylate CAS Name: 2-[(5-cyano-3,4-dimethyl-6-oxo-1-pyridazinyl)methyl]-4-methyl-3-quinolinecarboxylic acid methyl ester IUPAC Name: methyl 2-[(5-cyano-3,4-dimethyl-6-oxopyridazin-1-yl)methyl]-4-methylquinoline-3-carboxylate Traditional Name: 2-[(5-cyano-6-keto-3,4-dimethyl-pyridazin-1-yl)methyl]-4-methyl-quinoline-3-carboxylic acid methyl ester Formula: C20H18N4O3 MolecularWeight: 362.38192

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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)C)C#N

Isomeric SMILES

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

InChI

InChI=1S/C20H18N4O3/c1-11-13(3)23-24(19(25)15(11)9-21)10-17-18(20(26)27-4)12(2)14-7-5-6-8-16(14)22-17/h5-8H,10H2,1-4H3