1-[4-(4-methoxyphenyl)carbonylpiperidin-1-yl]-4-(5-phenyl-3,4-dihydropyrazol-2-yl)butane-1,4-dione

Systemtic Name: 1-[4-(4-methoxyphenyl)carbonylpiperidin-1-yl]-4-(5-phenyl-3,4-dihydropyrazol-2-yl)butane-1,4-dione Openeye Name: 1-[4-(4-methoxybenzoyl)-1-piperidyl]-4-(5-phenyl-3,4-dihydropyrazol-2-yl)butane-1,4-dione CAS Name: 1-[4-[(4-methoxyphenyl)-oxomethyl]-1-piperidinyl]-4-(5-phenyl-3,4-dihydropyrazol-2-yl)butane-1,4-dione IUPAC Name: 1-[4-(4-methoxybenzoyl)piperidin-1-yl]-4-(5-phenyl-3,4-dihydropyrazol-2-yl)butane-1,4-dione Traditional Name: 1-(4-p-anisoylpiperidino)-4-(3-phenyl-2-pyrazolin-1-yl)butane-1,4-dione Formula: C26H29N3O4 MolecularWeight: 447.52616

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)C2CCN(CC2)C(=O)CCC(=O)N3CCC(=N3)C4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)C2CCN(CC2)C(=O)CCC(=O)N3CCC(=N3)C4=CC=CC=C4

InChI

InChI=1S/C26H29N3O4/c1-33-22-9-7-20(8-10-22)26(32)21-13-16-28(17-14-21)24(30)11-12-25(31)29-18-15-23(27-29)19-5-3-2-4-6-19/h2-10,21H,11-18H2,1H3