ethyl 1-[[4-(4-methylphenyl)-1-oxidanylidene-phthalazin-2-yl]methyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[[4-(4-methylphenyl)-1-oxidanylidene-phthalazin-2-yl]methyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[[1-oxo-4-(p-tolyl)phthalazin-2-yl]methyl]piperidine-4-carboxylate CAS Name: 1-[[4-(4-methylphenyl)-1-oxo-2-phthalazinyl]methyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[[4-(4-methylphenyl)-1-oxophthalazin-2-yl]methyl]piperidine-4-carboxylate Traditional Name: 1-[[1-keto-4-(p-tolyl)phthalazin-2-yl]methyl]isonipecotic acid ethyl ester Formula: C24H27N3O3 MolecularWeight: 405.48948

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)CN2C(=O)C3=CC=CC=C3C(=N2)C4=CC=C(C=C4)C

Isomeric SMILES

CCOC(=O)C1CCN(CC1)CN2C(=O)C3=CC=CC=C3C(=N2)C4=CC=C(C=C4)C

InChI

InChI=1S/C24H27N3O3/c1-3-30-24(29)19-12-14-26(15-13-19)16-27-23(28)21-7-5-4-6-20(21)22(25-27)18-10-8-17(2)9-11-18/h4-11,19H,3,12-16H2,1-2H3