ethyl 1-[2-[6-(4-methylphenyl)-3-oxidanylidene-1,4-dihydropyridazin-2-yl]ethanoyl]piperidine-3-carboxylate

Systemtic Name: ethyl 1-[2-[6-(4-methylphenyl)-3-oxidanylidene-1,4-dihydropyridazin-2-yl]ethanoyl]piperidine-3-carboxylate Openeye Name: ethyl 1-[2-[3-oxo-6-(p-tolyl)-1,4-dihydropyridazin-2-yl]acetyl]piperidine-3-carboxylate CAS Name: 1-[2-[6-(4-methylphenyl)-3-oxo-1,4-dihydropyridazin-2-yl]-1-oxoethyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-[6-(4-methylphenyl)-3-oxo-1,4-dihydropyridazin-2-yl]acetyl]piperidine-3-carboxylate Traditional Name: 1-[2-[3-keto-6-(p-tolyl)-1,4-dihydropyridazin-2-yl]acetyl]nipecotic acid ethyl ester Formula: C21H27N3O4 MolecularWeight: 385.45678

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C(=O)CN2C(=O)CC=C(N2)C3=CC=C(C=C3)C

Isomeric SMILES

CCOC(=O)C1CCCN(C1)C(=O)CN2C(=O)CC=C(N2)C3=CC=C(C=C3)C

InChI

InChI=1S/C21H27N3O4/c1-3-28-21(27)17-5-4-12-23(13-17)20(26)14-24-19(25)11-10-18(22-24)16-8-6-15(2)7-9-16/h6-10,17,22H,3-5,11-14H2,1-2H3