(3S)-3-oxidanyl-1-(3-phenylpropyl)-3-(pyrrolidin-1-ium-1-ylmethyl)piperidin-2-one

Systemtic Name: (3S)-3-oxidanyl-1-(3-phenylpropyl)-3-(pyrrolidin-1-ium-1-ylmethyl)piperidin-2-one Openeye Name: (3S)-3-hydroxy-1-(3-phenylpropyl)-3-(pyrrolidin-1-ium-1-ylmethyl)piperidin-2-one CAS Name: (3S)-3-hydroxy-1-(3-phenylpropyl)-3-(1-pyrrolidin-1-iumylmethyl)-2-piperidinone IUPAC Name: (3S)-3-hydroxy-1-(3-phenylpropyl)-3-(pyrrolidin-1-ium-1-ylmethyl)piperidin-2-one Traditional Name: (3S)-3-hydroxy-1-(3-phenylpropyl)-3-(pyrrolidin-1-ium-1-ylmethyl)-2-piperidone Formula: C19H29N2O2+ MolecularWeight: 317.44576

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CC2(CCCN(C2=O)CCCC3=CC=CC=C3)O

Isomeric SMILES

C1CC[NH+](C1)C[C@]2(CCCN(C2=O)CCCC3=CC=CC=C3)O

InChI

InChI=1S/C19H28N2O2/c22-18-19(23,16-20-12-4-5-13-20)11-7-15-21(18)14-6-10-17-8-2-1-3-9-17/h1-3,8-9,23H,4-7,10-16H2/p+1/t19-/m0/s1