[(2S)-3-(1-adamantylmethoxy)-2-oxidanyl-propyl]-bis(2-methylpropyl)azanium

Systemtic Name: [(2S)-3-(1-adamantylmethoxy)-2-oxidanyl-propyl]-bis(2-methylpropyl)azanium Openeye Name: [(2S)-3-(1-adamantylmethoxy)-2-hydroxy-propyl]-diisobutyl-ammonium CAS Name: [(2S)-3-(1-adamantylmethoxy)-2-hydroxypropyl]-bis(2-methylpropyl)ammonium IUPAC Name: [(2S)-3-(1-adamantylmethoxy)-2-hydroxypropyl]-bis(2-methylpropyl)azanium Traditional Name: [(2S)-3-(1-adamantylmethoxy)-2-hydroxy-propyl]-diisobutyl-ammonium Formula: C22H42NO2+ MolecularWeight: 352.57438

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C[NH+](CC(C)C)CC(COCC12CC3CC(C1)CC(C3)C2)O

Isomeric SMILES

CC(C)C[NH+](C[C@@H](COCC12CC3CC(C1)CC(C3)C2)O)CC(C)C

InChI

InChI=1S/C22H41NO2/c1-16(2)11-23(12-17(3)4)13-21(24)14-25-15-22-8-18-5-19(9-22)7-20(6-18)10-22/h16-21,24H,5-15H2,1-4H3/p+1/t18?,19?,20?,21-,22?/m0/s1