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

Systemtic Name: (3S)-1-methyl-3-oxidanyl-3-[[4-(phenylcarbonyl)piperidin-1-ium-1-yl]methyl]piperidin-2-one Openeye Name: (3S)-3-[(4-benzoylpiperidin-1-ium-1-yl)methyl]-3-hydroxy-1-methyl-piperidin-2-one CAS Name: (3S)-3-[(4-benzoyl-1-piperidin-1-iumyl)methyl]-3-hydroxy-1-methyl-2-piperidinone IUPAC Name: (3S)-3-[(4-benzoylpiperidin-1-ium-1-yl)methyl]-3-hydroxy-1-methylpiperidin-2-one Traditional Name: (3S)-3-[(4-benzoylpiperidin-1-ium-1-yl)methyl]-3-hydroxy-1-methyl-2-piperidone Formula: C19H27N2O3+ MolecularWeight: 331.42928

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCCC(C1=O)(C[NH+]2CCC(CC2)C(=O)C3=CC=CC=C3)O

Isomeric SMILES

CN1CCC[C@@](C1=O)(C[NH+]2CCC(CC2)C(=O)C3=CC=CC=C3)O

InChI

InChI=1S/C19H26N2O3/c1-20-11-5-10-19(24,18(20)23)14-21-12-8-16(9-13-21)17(22)15-6-3-2-4-7-15/h2-4,6-7,16,24H,5,8-14H2,1H3/p+1/t19-/m0/s1