(3S)-1-[1-[3-(2-methylphenyl)phenyl]piperidin-4-yl]piperidin-1-ium-3-ol

Systemtic Name: (3S)-1-[1-[3-(2-methylphenyl)phenyl]piperidin-4-yl]piperidin-1-ium-3-ol Openeye Name: (3S)-1-[1-[3-(o-tolyl)phenyl]-4-piperidyl]piperidin-1-ium-3-ol CAS Name: (3S)-1-[1-[3-(2-methylphenyl)phenyl]-4-piperidinyl]-3-piperidin-1-iumol IUPAC Name: (3S)-1-[1-[3-(2-methylphenyl)phenyl]piperidin-4-yl]piperidin-1-ium-3-ol Traditional Name: (3S)-1-[1-[3-(o-tolyl)phenyl]-4-piperidyl]piperidin-1-ium-3-ol Formula: C23H31N2O+ MolecularWeight: 351.50504

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=CC(=CC=C2)N3CCC(CC3)[NH+]4CCCC(C4)O

Isomeric SMILES

CC1=CC=CC=C1C2=CC(=CC=C2)N3CCC(CC3)[NH+]4CCC[C@@H](C4)O

InChI

InChI=1S/C23H30N2O/c1-18-6-2-3-10-23(18)19-7-4-8-21(16-19)24-14-11-20(12-15-24)25-13-5-9-22(26)17-25/h2-4,6-8,10,16,20,22,26H,5,9,11-15,17H2,1H3/p+1/t22-/m0/s1