1,5-dimethyl-4-[[3-[methyl(phenethyl)amino]piperidin-1-yl]methyl]-2-phenyl-pyrazol-3-one

Systemtic Name: 1,5-dimethyl-4-[[3-[methyl(phenethyl)amino]piperidin-1-yl]methyl]-2-phenyl-pyrazol-3-one Openeye Name: 1,5-dimethyl-4-[[3-[methyl(phenethyl)amino]-1-piperidyl]methyl]-2-phenyl-pyrazol-3-one CAS Name: 1,5-dimethyl-4-[[3-[methyl(phenethyl)amino]-1-piperidinyl]methyl]-2-phenyl-3-pyrazolone IUPAC Name: 1,5-dimethyl-4-[[3-[methyl(phenethyl)amino]piperidin-1-yl]methyl]-2-phenylpyrazol-3-one Traditional Name: 1,5-dimethyl-4-[[3-[methyl(phenethyl)amino]piperidino]methyl]-2-phenyl-3-pyrazolin-3-one Formula: C26H34N4O MolecularWeight: 418.57436

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)CN3CCCC(C3)N(C)CCC4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)CN3CCCC(C3)N(C)CCC4=CC=CC=C4

InChI

InChI=1S/C26H34N4O/c1-21-25(26(31)30(28(21)3)23-13-8-5-9-14-23)20-29-17-10-15-24(19-29)27(2)18-16-22-11-6-4-7-12-22/h4-9,11-14,24H,10,15-20H2,1-3H3