[(1R,2R)-3-methyl-1-phenyl-1-pyridin-4-yl-butan-2-yl]-bis(phenylmethyl)azanium

Systemtic Name: [(1R,2R)-3-methyl-1-phenyl-1-pyridin-4-yl-butan-2-yl]-bis(phenylmethyl)azanium Openeye Name: dibenzyl-[(1R)-2-methyl-1-[(R)-phenyl(4-pyridyl)methyl]propyl]ammonium CAS Name: [(1R,2R)-3-methyl-1-phenyl-1-pyridin-4-ylbutan-2-yl]-bis(phenylmethyl)ammonium IUPAC Name: dibenzyl-[(1R,2R)-3-methyl-1-phenyl-1-pyridin-4-ylbutan-2-yl]azanium Traditional Name: dibenzyl-[(1R)-2-methyl-1-[(R)-phenyl(4-pyridyl)methyl]propyl]ammonium Formula: C30H33N2+ MolecularWeight: 421.59642

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(C1=CC=CC=C1)C2=CC=NC=C2)[NH+](CC3=CC=CC=C3)CC4=CC=CC=C4

Isomeric SMILES

CC(C)[C@H]([C@H](C1=CC=CC=C1)C2=CC=NC=C2)[NH+](CC3=CC=CC=C3)CC4=CC=CC=C4

InChI

InChI=1S/C30H32N2/c1-24(2)30(29(27-16-10-5-11-17-27)28-18-20-31-21-19-28)32(22-25-12-6-3-7-13-25)23-26-14-8-4-9-15-26/h3-21,24,29-30H,22-23H2,1-2H3/p+1/t29-,30-/m1/s1