1-[4-[1-(2-methylpyridin-3-yl)-2-oxidanyl-ethyl]piperazin-1-yl]-3,3-diphenyl-propan-1-one

Systemtic Name: 1-[4-[1-(2-methylpyridin-3-yl)-2-oxidanyl-ethyl]piperazin-1-yl]-3,3-diphenyl-propan-1-one Openeye Name: 1-[4-[2-hydroxy-1-(2-methyl-3-pyridyl)ethyl]piperazin-1-yl]-3,3-diphenyl-propan-1-one CAS Name: 1-[4-[2-hydroxy-1-(2-methyl-3-pyridinyl)ethyl]-1-piperazinyl]-3,3-diphenyl-1-propanone IUPAC Name: 1-[4-[2-hydroxy-1-(2-methylpyridin-3-yl)ethyl]piperazin-1-yl]-3,3-diphenylpropan-1-one Traditional Name: 1-[4-[2-hydroxy-1-(2-methyl-3-pyridyl)ethyl]piperazino]-3,3-diphenyl-propan-1-one Formula: C27H31N3O2 MolecularWeight: 429.55394

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=N1)C(CO)N2CCN(CC2)C(=O)CC(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=C(C=CC=N1)C(CO)N2CCN(CC2)C(=O)CC(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C27H31N3O2/c1-21-24(13-8-14-28-21)26(20-31)29-15-17-30(18-16-29)27(32)19-25(22-9-4-2-5-10-22)23-11-6-3-7-12-23/h2-14,25-26,31H,15-20H2,1H3