5-methyl-4-(phenylmethyl)-2-[1-(phenylmethyl)piperidin-4-yl]-1H-pyrazol-3-one

Systemtic Name: 5-methyl-4-(phenylmethyl)-2-[1-(phenylmethyl)piperidin-4-yl]-1H-pyrazol-3-one Openeye Name: 4-benzyl-2-(1-benzyl-4-piperidyl)-5-methyl-1H-pyrazol-3-one CAS Name: 5-methyl-4-(phenylmethyl)-2-[1-(phenylmethyl)-4-piperidinyl]-1H-pyrazol-3-one IUPAC Name: 4-benzyl-2-(1-benzylpiperidin-4-yl)-5-methyl-1H-pyrazol-3-one Traditional Name: 4-benzyl-2-(1-benzyl-4-piperidyl)-5-methyl-3-pyrazolin-3-one Formula: C23H27N3O MolecularWeight: 361.47998

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1)C2CCN(CC2)CC3=CC=CC=C3)CC4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=O)N(N1)C2CCN(CC2)CC3=CC=CC=C3)CC4=CC=CC=C4

InChI

InChI=1S/C23H27N3O/c1-18-22(16-19-8-4-2-5-9-19)23(27)26(24-18)21-12-14-25(15-13-21)17-20-10-6-3-7-11-20/h2-11,21,24H,12-17H2,1H3