(3R,4R)-1-[[4-(2-methylphenyl)phenyl]methyl]-4-morpholin-4-ium-4-yl-piperidin-1-ium-3-ol

Systemtic Name: (3R,4R)-1-[[4-(2-methylphenyl)phenyl]methyl]-4-morpholin-4-ium-4-yl-piperidin-1-ium-3-ol Openeye Name: (3R,4R)-4-morpholin-4-ium-4-yl-1-[[4-(o-tolyl)phenyl]methyl]piperidin-1-ium-3-ol CAS Name: (3R,4R)-1-[[4-(2-methylphenyl)phenyl]methyl]-4-(4-morpholin-4-iumyl)-3-piperidin-1-iumol IUPAC Name: (3R,4R)-1-[[4-(2-methylphenyl)phenyl]methyl]-4-morpholin-4-ium-4-ylpiperidin-1-ium-3-ol Traditional Name: (3R,4R)-4-morpholin-4-ium-4-yl-1-[4-(o-tolyl)benzyl]piperidin-1-ium-3-ol Formula: C23H32N2O2+2 MolecularWeight: 368.51238

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=CC=C(C=C2)C[NH+]3CCC(C(C3)O)[NH+]4CCOCC4

Isomeric SMILES

CC1=CC=CC=C1C2=CC=C(C=C2)C[NH+]3CC[C@H]([C@@H](C3)O)[NH+]4CCOCC4

InChI

InChI=1S/C23H30N2O2/c1-18-4-2-3-5-21(18)20-8-6-19(7-9-20)16-24-11-10-22(23(26)17-24)25-12-14-27-15-13-25/h2-9,22-23,26H,10-17H2,1H3/p+2/t22-,23-/m1/s1