[1-[(3S)-1-[(3-chlorophenyl)methyl]piperidin-1-ium-3-yl]piperidin-4-yl]methanol

Systemtic Name: [1-[(3S)-1-[(3-chlorophenyl)methyl]piperidin-1-ium-3-yl]piperidin-4-yl]methanol Openeye Name: [1-[(3S)-1-[(3-chlorophenyl)methyl]piperidin-1-ium-3-yl]-4-piperidyl]methanol CAS Name: [1-[(3S)-1-[(3-chlorophenyl)methyl]-3-piperidin-1-iumyl]-4-piperidinyl]methanol IUPAC Name: [1-[(3S)-1-[(3-chlorophenyl)methyl]piperidin-1-ium-3-yl]piperidin-4-yl]methanol Traditional Name: [1-[(3S)-1-(3-chlorobenzyl)piperidin-1-ium-3-yl]-4-piperidyl]methanol Formula: C18H28ClN2O+ MolecularWeight: 323.88072

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C[NH+](C1)CC2=CC(=CC=C2)Cl)N3CCC(CC3)CO

Isomeric SMILES

C1C[C@@H](C[NH+](C1)CC2=CC(=CC=C2)Cl)N3CCC(CC3)CO

InChI

InChI=1S/C18H27ClN2O/c19-17-4-1-3-16(11-17)12-20-8-2-5-18(13-20)21-9-6-15(14-22)7-10-21/h1,3-4,11,15,18,22H,2,5-10,12-14H2/p+1/t18-/m0/s1