[(1S,2R)-1-(1-adamantyl)-1-oxidanyl-propan-2-yl]-propan-2-yl-azanium

Systemtic Name: [(1S,2R)-1-(1-adamantyl)-1-oxidanyl-propan-2-yl]-propan-2-yl-azanium Openeye Name: [(1R,2S)-2-(1-adamantyl)-2-hydroxy-1-methyl-ethyl]-isopropyl-ammonium CAS Name: [(1S,2R)-1-(1-adamantyl)-1-hydroxypropan-2-yl]-propan-2-ylammonium IUPAC Name: [(1S,2R)-1-(1-adamantyl)-1-hydroxypropan-2-yl]-propan-2-ylazanium Traditional Name: [(1R,2S)-2-(1-adamantyl)-2-hydroxy-1-methyl-ethyl]-isopropyl-ammonium Formula: C16H30NO+ MolecularWeight: 252.4155

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH2+]C(C)C(C12CC3CC(C1)CC(C3)C2)O

Isomeric SMILES

C[C@H]([C@H](C12CC3CC(C1)CC(C3)C2)O)[NH2+]C(C)C

InChI

InChI=1S/C16H29NO/c1-10(2)17-11(3)15(18)16-7-12-4-13(8-16)6-14(5-12)9-16/h10-15,17-18H,4-9H2,1-3H3/p+1/t11-,12?,13?,14?,15-,16?/m1/s1