(3S)-1-[(2-fluoranyl-5-methoxy-phenyl)methyl]-3-[(4-methylpiperidin-1-ium-1-yl)methyl]-3-oxidanyl-piperidin-2-one

Systemtic Name: (3S)-1-[(2-fluoranyl-5-methoxy-phenyl)methyl]-3-[(4-methylpiperidin-1-ium-1-yl)methyl]-3-oxidanyl-piperidin-2-one Openeye Name: (3S)-1-[(2-fluoro-5-methoxy-phenyl)methyl]-3-hydroxy-3-[(4-methylpiperidin-1-ium-1-yl)methyl]piperidin-2-one CAS Name: (3S)-1-[(2-fluoro-5-methoxyphenyl)methyl]-3-hydroxy-3-[(4-methyl-1-piperidin-1-iumyl)methyl]-2-piperidinone IUPAC Name: (3S)-1-[(2-fluoro-5-methoxyphenyl)methyl]-3-hydroxy-3-[(4-methylpiperidin-1-ium-1-yl)methyl]piperidin-2-one Traditional Name: (3S)-1-(2-fluoro-5-methoxy-benzyl)-3-hydroxy-3-[(4-methylpiperidin-1-ium-1-yl)methyl]-2-piperidone Formula: C20H30FN2O3+ MolecularWeight: 365.462203

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H29FN2O3/c1-15-6-10-22(11-7-15)14-20(25)8-3-9-23(19(20)24)13-16-12-17(26-2)4-5-18(16)21/h4-5,12,15,25H,3,6-11,13-14H2,1-2H3/p+1/t20-/m0/s1