(3R)-3-oxidanyl-1-phenethyl-3-[(4-propan-2-ylpiperazin-4-ium-1-yl)methyl]piperidin-2-one

Systemtic Name: (3R)-3-oxidanyl-1-phenethyl-3-[(4-propan-2-ylpiperazin-4-ium-1-yl)methyl]piperidin-2-one Openeye Name: (3R)-3-hydroxy-3-[(4-isopropylpiperazin-4-ium-1-yl)methyl]-1-phenethyl-piperidin-2-one CAS Name: (3R)-3-hydroxy-1-phenethyl-3-[(4-propan-2-yl-1-piperazin-4-iumyl)methyl]-2-piperidinone IUPAC Name: (3R)-3-hydroxy-1-phenethyl-3-[(4-propan-2-ylpiperazin-4-ium-1-yl)methyl]piperidin-2-one Traditional Name: (3R)-3-hydroxy-3-[(4-isopropylpiperazin-4-ium-1-yl)methyl]-1-phenethyl-2-piperidone Formula: C21H34N3O2+ MolecularWeight: 360.51356

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+]1CCN(CC1)CC2(CCCN(C2=O)CCC3=CC=CC=C3)O

Isomeric SMILES

CC(C)[NH+]1CCN(CC1)C[C@@]2(CCCN(C2=O)CCC3=CC=CC=C3)O

InChI

InChI=1S/C21H33N3O2/c1-18(2)23-15-13-22(14-16-23)17-21(26)10-6-11-24(20(21)25)12-9-19-7-4-3-5-8-19/h3-5,7-8,18,26H,6,9-17H2,1-2H3/p+1/t21-/m1/s1