3-(2,5-dimethoxyphenyl)-1-[2-[1-(phenylcarbonyl)piperidin-4-yl]carbonylpyrazolidin-1-yl]prop-2-en-1-one

Systemtic Name: 3-(2,5-dimethoxyphenyl)-1-[2-[1-(phenylcarbonyl)piperidin-4-yl]carbonylpyrazolidin-1-yl]prop-2-en-1-one Openeye Name: 1-[2-(1-benzoylpiperidine-4-carbonyl)pyrazolidin-1-yl]-3-(2,5-dimethoxyphenyl)prop-2-en-1-one CAS Name: 1-[2-[(1-benzoyl-4-piperidinyl)-oxomethyl]-1-pyrazolidinyl]-3-(2,5-dimethoxyphenyl)-2-propen-1-one IUPAC Name: 1-[2-(1-benzoylpiperidine-4-carbonyl)pyrazolidin-1-yl]-3-(2,5-dimethoxyphenyl)prop-2-en-1-one Traditional Name: 1-[2-(1-benzoylisonipecotoyl)pyrazolidin-1-yl]-3-(2,5-dimethoxyphenyl)prop-2-en-1-one Formula: C27H31N3O5 MolecularWeight: 477.55214

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)C=CC(=O)N2CCCN2C(=O)C3CCN(CC3)C(=O)C4=CC=CC=C4

Isomeric SMILES

COC1=CC(=C(C=C1)OC)C=CC(=O)N2CCCN2C(=O)C3CCN(CC3)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C27H31N3O5/c1-34-23-10-11-24(35-2)22(19-23)9-12-25(31)29-15-6-16-30(29)27(33)21-13-17-28(18-14-21)26(32)20-7-4-3-5-8-20/h3-5,7-12,19,21H,6,13-18H2,1-2H3