5-(3,4-dimethoxyphenyl)-4,4-dimethyl-2-(1-quinolin-8-ylcarbonylpiperidin-4-yl)pyrazol-3-one

Systemtic Name: 5-(3,4-dimethoxyphenyl)-4,4-dimethyl-2-(1-quinolin-8-ylcarbonylpiperidin-4-yl)pyrazol-3-one Openeye Name: 5-(3,4-dimethoxyphenyl)-4,4-dimethyl-2-[1-(quinoline-8-carbonyl)-4-piperidyl]pyrazol-3-one CAS Name: 5-(3,4-dimethoxyphenyl)-4,4-dimethyl-2-[1-[oxo(8-quinolinyl)methyl]-4-piperidinyl]-3-pyrazolone IUPAC Name: 5-(3,4-dimethoxyphenyl)-4,4-dimethyl-2-[1-(quinoline-8-carbonyl)piperidin-4-yl]pyrazol-3-one Traditional Name: 5-(3,4-dimethoxyphenyl)-4,4-dimethyl-2-[1-(quinoline-8-carbonyl)-4-piperidyl]-2-pyrazolin-3-one Formula: C28H30N4O4 MolecularWeight: 486.5622

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=NN(C1=O)C2CCN(CC2)C(=O)C3=CC=CC4=C3N=CC=C4)C5=CC(=C(C=C5)OC)OC)C

Isomeric SMILES

CC1(C(=NN(C1=O)C2CCN(CC2)C(=O)C3=CC=CC4=C3N=CC=C4)C5=CC(=C(C=C5)OC)OC)C

InChI

InChI=1S/C28H30N4O4/c1-28(2)25(19-10-11-22(35-3)23(17-19)36-4)30-32(27(28)34)20-12-15-31(16-13-20)26(33)21-9-5-7-18-8-6-14-29-24(18)21/h5-11,14,17,20H,12-13,15-16H2,1-4H3