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

Systemtic Name: (3S)-3-oxidanyl-1-(3-phenylpropyl)-3-[(4-pyrrolidin-1-ium-1-ylpiperidin-1-ium-1-yl)methyl]piperidin-2-one Openeye Name: (3S)-3-hydroxy-1-(3-phenylpropyl)-3-[(4-pyrrolidin-1-ium-1-ylpiperidin-1-ium-1-yl)methyl]piperidin-2-one CAS Name: (3S)-3-hydroxy-1-(3-phenylpropyl)-3-[[4-(1-pyrrolidin-1-iumyl)-1-piperidin-1-iumyl]methyl]-2-piperidinone IUPAC Name: (3S)-3-hydroxy-1-(3-phenylpropyl)-3-[(4-pyrrolidin-1-ium-1-ylpiperidin-1-ium-1-yl)methyl]piperidin-2-one Traditional Name: (3S)-3-hydroxy-1-(3-phenylpropyl)-3-[(4-pyrrolidin-1-ium-1-ylpiperidin-1-ium-1-yl)methyl]-2-piperidone Formula: C24H39N3O2+2 MolecularWeight: 401.58536

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)C2CC[NH+](CC2)CC3(CCCN(C3=O)CCCC4=CC=CC=C4)O

Isomeric SMILES

C1CC[NH+](C1)C2CC[NH+](CC2)C[C@]3(CCCN(C3=O)CCCC4=CC=CC=C4)O

InChI

InChI=1S/C24H37N3O2/c28-23-24(29,20-25-18-11-22(12-19-25)26-14-4-5-15-26)13-7-17-27(23)16-6-10-21-8-2-1-3-9-21/h1-3,8-9,22,29H,4-7,10-20H2/p+2/t24-/m0/s1