(3S)-1-[(3-methoxyphenyl)methyl]-3-[(4-methylpiperidin-1-ium-1-yl)methyl]-3-oxidanyl-piperidin-2-one

Systemtic Name: (3S)-1-[(3-methoxyphenyl)methyl]-3-[(4-methylpiperidin-1-ium-1-yl)methyl]-3-oxidanyl-piperidin-2-one Openeye Name: (3S)-3-hydroxy-1-[(3-methoxyphenyl)methyl]-3-[(4-methylpiperidin-1-ium-1-yl)methyl]piperidin-2-one CAS Name: (3S)-3-hydroxy-1-[(3-methoxyphenyl)methyl]-3-[(4-methyl-1-piperidin-1-iumyl)methyl]-2-piperidinone IUPAC Name: (3S)-3-hydroxy-1-[(3-methoxyphenyl)methyl]-3-[(4-methylpiperidin-1-ium-1-yl)methyl]piperidin-2-one Traditional Name: (3S)-3-hydroxy-1-m-anisyl-3-[(4-methylpiperidin-1-ium-1-yl)methyl]-2-piperidone Formula: C20H31N2O3+ MolecularWeight: 347.47174

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)CC2(CCCN(C2=O)CC3=CC(=CC=C3)OC)O

Isomeric SMILES

CC1CC[NH+](CC1)C[C@]2(CCCN(C2=O)CC3=CC(=CC=C3)OC)O

InChI

InChI=1S/C20H30N2O3/c1-16-7-11-21(12-8-16)15-20(24)9-4-10-22(19(20)23)14-17-5-3-6-18(13-17)25-2/h3,5-6,13,16,24H,4,7-12,14-15H2,1-2H3/p+1/t20-/m0/s1