5-(3,4-dimethoxyphenyl)-4,4-dimethyl-2-[1-(1,8-naphthyridin-2-ylcarbonyl)piperidin-4-yl]pyrazol-3-one

Systemtic Name: 5-(3,4-dimethoxyphenyl)-4,4-dimethyl-2-[1-(1,8-naphthyridin-2-ylcarbonyl)piperidin-4-yl]pyrazol-3-one Openeye Name: 5-(3,4-dimethoxyphenyl)-4,4-dimethyl-2-[1-(1,8-naphthyridine-2-carbonyl)-4-piperidyl]pyrazol-3-one CAS Name: 5-(3,4-dimethoxyphenyl)-4,4-dimethyl-2-[1-[1,8-naphthyridin-2-yl(oxo)methyl]-4-piperidinyl]-3-pyrazolone IUPAC Name: 5-(3,4-dimethoxyphenyl)-4,4-dimethyl-2-[1-(1,8-naphthyridine-2-carbonyl)piperidin-4-yl]pyrazol-3-one Traditional Name: 5-(3,4-dimethoxyphenyl)-4,4-dimethyl-2-[1-(1,8-naphthyridine-2-carbonyl)-4-piperidyl]-2-pyrazolin-3-one Formula: C27H29N5O4 MolecularWeight: 487.55026

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=NN(C1=O)C2CCN(CC2)C(=O)C3=NC4=C(C=CC=N4)C=C3)C5=CC(=C(C=C5)OC)OC)C

Isomeric SMILES

CC1(C(=NN(C1=O)C2CCN(CC2)C(=O)C3=NC4=C(C=CC=N4)C=C3)C5=CC(=C(C=C5)OC)OC)C

InChI

InChI=1S/C27H29N5O4/c1-27(2)23(18-8-10-21(35-3)22(16-18)36-4)30-32(26(27)34)19-11-14-31(15-12-19)25(33)20-9-7-17-6-5-13-28-24(17)29-20/h5-10,13,16,19H,11-12,14-15H2,1-4H3