dimethyl-[(2R,5R)-5-oxidanyl-4,4-diphenyl-heptan-2-yl]azanium

Systemtic Name: dimethyl-[(2R,5R)-5-oxidanyl-4,4-diphenyl-heptan-2-yl]azanium Openeye Name: [(1R,4R)-4-hydroxy-1-methyl-3,3-diphenyl-hexyl]-dimethyl-ammonium CAS Name: [(2R,5R)-5-hydroxy-4,4-diphenylheptan-2-yl]-dimethylammonium IUPAC Name: [(2R,5R)-5-hydroxy-4,4-diphenylheptan-2-yl]-dimethylazanium Traditional Name: [(1R,4R)-4-hydroxy-1-methyl-3,3-diphenyl-hexyl]-dimethyl-ammonium Formula: C21H30NO+ MolecularWeight: 312.469

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H29NO/c1-5-20(23)21(16-17(2)22(3)4,18-12-8-6-9-13-18)19-14-10-7-11-15-19/h6-15,17,20,23H,5,16H2,1-4H3/p+1/t17-,20-/m1/s1