3-[[2-(4-methylpiperazin-1-yl)phenyl]methyl]-1-[4-(2-oxidanylpropan-2-yl)phenyl]piperidin-2-one

Systemtic Name: 3-[[2-(4-methylpiperazin-1-yl)phenyl]methyl]-1-[4-(2-oxidanylpropan-2-yl)phenyl]piperidin-2-one Openeye Name: 1-[4-(1-hydroxy-1-methyl-ethyl)phenyl]-3-[[2-(4-methylpiperazin-1-yl)phenyl]methyl]piperidin-2-one CAS Name: 1-[4-(2-hydroxypropan-2-yl)phenyl]-3-[[2-(4-methyl-1-piperazinyl)phenyl]methyl]-2-piperidinone IUPAC Name: 1-[4-(2-hydroxypropan-2-yl)phenyl]-3-[[2-(4-methylpiperazin-1-yl)phenyl]methyl]piperidin-2-one Traditional Name: 1-[4-(1-hydroxy-1-methyl-ethyl)phenyl]-3-[2-(4-methylpiperazino)benzyl]-2-piperidone Formula: C26H35N3O2 MolecularWeight: 421.575

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=CC=C(C=C1)N2CCCC(C2=O)CC3=CC=CC=C3N4CCN(CC4)C)O

Isomeric SMILES

CC(C)(C1=CC=C(C=C1)N2CCCC(C2=O)CC3=CC=CC=C3N4CCN(CC4)C)O

InChI

InChI=1S/C26H35N3O2/c1-26(2,31)22-10-12-23(13-11-22)29-14-6-8-21(25(29)30)19-20-7-4-5-9-24(20)28-17-15-27(3)16-18-28/h4-5,7,9-13,21,31H,6,8,14-19H2,1-3H3