[3-(hydroxymethyl)-2,4,6-trimethyl-phenyl]methyl-[(2R)-6-methyl-6-oxidanyl-heptan-2-yl]azanium

Systemtic Name: [3-(hydroxymethyl)-2,4,6-trimethyl-phenyl]methyl-[(2R)-6-methyl-6-oxidanyl-heptan-2-yl]azanium Openeye Name: [(1R)-5-hydroxy-1,5-dimethyl-hexyl]-[[3-(hydroxymethyl)-2,4,6-trimethyl-phenyl]methyl]ammonium CAS Name: [(2R)-6-hydroxy-6-methylheptan-2-yl]-[[3-(hydroxymethyl)-2,4,6-trimethylphenyl]methyl]ammonium IUPAC Name: [(2R)-6-hydroxy-6-methylheptan-2-yl]-[[3-(hydroxymethyl)-2,4,6-trimethylphenyl]methyl]azanium Traditional Name: [(1R)-5-hydroxy-1,5-dimethyl-hexyl]-(2,4,6-trimethyl-3-methylol-benzyl)ammonium Formula: C19H34NO2+ MolecularWeight: 308.47876

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1C[NH2+]C(C)CCCC(C)(C)O)C)CO)C

Isomeric SMILES

CC1=CC(=C(C(=C1C[NH2+][C@H](C)CCCC(C)(C)O)C)CO)C

InChI

InChI=1S/C19H33NO2/c1-13-10-14(2)18(12-21)16(4)17(13)11-20-15(3)8-7-9-19(5,6)22/h10,15,20-22H,7-9,11-12H2,1-6H3/p+1/t15-/m1/s1