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

Systemtic Name: 5-methyl-4-(phenylmethyl)-2-piperidin-4-yl-1H-pyrazol-3-one Openeye Name: 4-benzyl-5-methyl-2-(4-piperidyl)-1H-pyrazol-3-one CAS Name: 5-methyl-4-(phenylmethyl)-2-(4-piperidinyl)-1H-pyrazol-3-one IUPAC Name: 4-benzyl-5-methyl-2-piperidin-4-yl-1H-pyrazol-3-one Traditional Name: 4-benzyl-5-methyl-2-(4-piperidyl)-3-pyrazolin-3-one Formula: C16H21N3O MolecularWeight: 271.35744

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1)C2CCNCC2)CC3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=O)N(N1)C2CCNCC2)CC3=CC=CC=C3

InChI

InChI=1S/C16H21N3O/c1-12-15(11-13-5-3-2-4-6-13)16(20)19(18-12)14-7-9-17-10-8-14/h2-6,14,17-18H,7-11H2,1H3