3-[3-[(3S)-3-(4-methoxy-2-methyl-phenyl)carbonylpiperidin-1-yl]-3-oxidanylidene-propyl]-4,5-dihydro-1H-pyridazin-6-one

Systemtic Name: 3-[3-[(3S)-3-(4-methoxy-2-methyl-phenyl)carbonylpiperidin-1-yl]-3-oxidanylidene-propyl]-4,5-dihydro-1H-pyridazin-6-one Openeye Name: 3-[3-[(3S)-3-(4-methoxy-2-methyl-benzoyl)-1-piperidyl]-3-oxo-propyl]-4,5-dihydro-1H-pyridazin-6-one CAS Name: 3-[3-[(3S)-3-[(4-methoxy-2-methylphenyl)-oxomethyl]-1-piperidinyl]-3-oxopropyl]-4,5-dihydro-1H-pyridazin-6-one IUPAC Name: 3-[3-[(3S)-3-(4-methoxy-2-methylbenzoyl)piperidin-1-yl]-3-oxopropyl]-4,5-dihydro-1H-pyridazin-6-one Traditional Name: 3-[3-keto-3-[(3S)-3-(4-methoxy-2-methyl-benzoyl)piperidino]propyl]-4,5-dihydro-1H-pyridazin-6-one Formula: C21H27N3O4 MolecularWeight: 385.45678

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OC)C(=O)C2CCCN(C2)C(=O)CCC3=NNC(=O)CC3

Isomeric SMILES

CC1=C(C=CC(=C1)OC)C(=O)[C@H]2CCCN(C2)C(=O)CCC3=NNC(=O)CC3

InChI

InChI=1S/C21H27N3O4/c1-14-12-17(28-2)7-8-18(14)21(27)15-4-3-11-24(13-15)20(26)10-6-16-5-9-19(25)23-22-16/h7-8,12,15H,3-6,9-11,13H2,1-2H3,(H,23,25)/t15-/m0/s1