methyl 6-(4-methoxyphenyl)-3-oxidanylidene-2-(3-phenylpropyl)pyridazine-4-carboxylate

Systemtic Name: methyl 6-(4-methoxyphenyl)-3-oxidanylidene-2-(3-phenylpropyl)pyridazine-4-carboxylate Openeye Name: methyl 6-(4-methoxyphenyl)-3-oxo-2-(3-phenylpropyl)pyridazine-4-carboxylate CAS Name: 6-(4-methoxyphenyl)-3-oxo-2-(3-phenylpropyl)-4-pyridazinecarboxylic acid methyl ester IUPAC Name: methyl 6-(4-methoxyphenyl)-3-oxo-2-(3-phenylpropyl)pyridazine-4-carboxylate Traditional Name: 3-keto-6-(4-methoxyphenyl)-2-(3-phenylpropyl)pyridazine-4-carboxylic acid methyl ester Formula: C22H22N2O4 MolecularWeight: 378.42108

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NN(C(=O)C(=C2)C(=O)OC)CCCC3=CC=CC=C3

Isomeric SMILES

COC1=CC=C(C=C1)C2=NN(C(=O)C(=C2)C(=O)OC)CCCC3=CC=CC=C3

InChI

InChI=1S/C22H22N2O4/c1-27-18-12-10-17(11-13-18)20-15-19(22(26)28-2)21(25)24(23-20)14-6-9-16-7-4-3-5-8-16/h3-5,7-8,10-13,15H,6,9,14H2,1-2H3