4-[(1S,2R)-3-methyl-1-phenyl-1-pyridin-2-yl-butan-2-yl]morpholin-4-ium

Systemtic Name: 4-[(1S,2R)-3-methyl-1-phenyl-1-pyridin-2-yl-butan-2-yl]morpholin-4-ium Openeye Name: 4-[(1R)-2-methyl-1-[(S)-phenyl(2-pyridyl)methyl]propyl]morpholin-4-ium CAS Name: 4-[(1S,2R)-3-methyl-1-phenyl-1-(2-pyridinyl)butan-2-yl]morpholin-4-ium IUPAC Name: 4-[(1S,2R)-3-methyl-1-phenyl-1-pyridin-2-ylbutan-2-yl]morpholin-4-ium Traditional Name: 4-[(1R)-2-methyl-1-[(S)-phenyl(2-pyridyl)methyl]propyl]morpholin-4-ium Formula: C20H27N2O+ MolecularWeight: 311.44118

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(C1=CC=CC=C1)C2=CC=CC=N2)[NH+]3CCOCC3

Isomeric SMILES

CC(C)[C@H]([C@H](C1=CC=CC=C1)C2=CC=CC=N2)[NH+]3CCOCC3

InChI

InChI=1S/C20H26N2O/c1-16(2)20(22-12-14-23-15-13-22)19(17-8-4-3-5-9-17)18-10-6-7-11-21-18/h3-11,16,19-20H,12-15H2,1-2H3/p+1/t19-,20-/m1/s1