dimethyl-[(4S,5R)-4-methyl-4-oxidanyl-5,6-diphenyl-hexyl]azanium

Systemtic Name: dimethyl-[(4S,5R)-4-methyl-4-oxidanyl-5,6-diphenyl-hexyl]azanium Openeye Name: [(4S,5R)-4-hydroxy-4-methyl-5,6-diphenyl-hexyl]-dimethyl-ammonium CAS Name: [(4S,5R)-4-hydroxy-4-methyl-5,6-diphenylhexyl]-dimethylammonium IUPAC Name: [(4S,5R)-4-hydroxy-4-methyl-5,6-diphenylhexyl]-dimethylazanium Traditional Name: [(4S,5R)-4-hydroxy-4-methyl-5,6-diphenyl-hexyl]-dimethyl-ammonium Formula: C21H30NO+ MolecularWeight: 312.469

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC[NH+](C)C)(C(CC1=CC=CC=C1)C2=CC=CC=C2)O

Isomeric SMILES

C[C@](CCC[NH+](C)C)([C@H](CC1=CC=CC=C1)C2=CC=CC=C2)O

InChI

InChI=1S/C21H29NO/c1-21(23,15-10-16-22(2)3)20(19-13-8-5-9-14-19)17-18-11-6-4-7-12-18/h4-9,11-14,20,23H,10,15-17H2,1-3H3/p+1/t20-,21+/m1/s1