5-(3,4-dimethoxyphenyl)-2-[1-(3-ethoxyphenyl)carbonylpiperidin-4-yl]-4,4-dimethyl-pyrazol-3-one

Systemtic Name: 5-(3,4-dimethoxyphenyl)-2-[1-(3-ethoxyphenyl)carbonylpiperidin-4-yl]-4,4-dimethyl-pyrazol-3-one Openeye Name: 5-(3,4-dimethoxyphenyl)-2-[1-(3-ethoxybenzoyl)-4-piperidyl]-4,4-dimethyl-pyrazol-3-one CAS Name: 5-(3,4-dimethoxyphenyl)-2-[1-[(3-ethoxyphenyl)-oxomethyl]-4-piperidinyl]-4,4-dimethyl-3-pyrazolone IUPAC Name: 5-(3,4-dimethoxyphenyl)-2-[1-(3-ethoxybenzoyl)piperidin-4-yl]-4,4-dimethylpyrazol-3-one Traditional Name: 5-(3,4-dimethoxyphenyl)-2-[1-(3-ethoxybenzoyl)-4-piperidyl]-4,4-dimethyl-2-pyrazolin-3-one Formula: C27H33N3O5 MolecularWeight: 479.56802

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1)C(=O)N2CCC(CC2)N3C(=O)C(C(=N3)C4=CC(=C(C=C4)OC)OC)(C)C

Isomeric SMILES

CCOC1=CC=CC(=C1)C(=O)N2CCC(CC2)N3C(=O)C(C(=N3)C4=CC(=C(C=C4)OC)OC)(C)C

InChI

InChI=1S/C27H33N3O5/c1-6-35-21-9-7-8-19(16-21)25(31)29-14-12-20(13-15-29)30-26(32)27(2,3)24(28-30)18-10-11-22(33-4)23(17-18)34-5/h7-11,16-17,20H,6,12-15H2,1-5H3