[(3S)-3,7-dimethyl-7-oxidanyl-octyl]-[3-(2-methyl-1H-imidazol-3-ium-3-yl)propyl]azanium

Systemtic Name: [(3S)-3,7-dimethyl-7-oxidanyl-octyl]-[3-(2-methyl-1H-imidazol-3-ium-3-yl)propyl]azanium Openeye Name: [(3S)-7-hydroxy-3,7-dimethyl-octyl]-[3-(2-methyl-1H-imidazol-3-ium-3-yl)propyl]ammonium CAS Name: [(3S)-7-hydroxy-3,7-dimethyloctyl]-[3-(2-methyl-1H-imidazol-3-ium-3-yl)propyl]ammonium IUPAC Name: [(3S)-7-hydroxy-3,7-dimethyloctyl]-[3-(2-methyl-1H-imidazol-3-ium-3-yl)propyl]azanium Traditional Name: [(3S)-7-hydroxy-3,7-dimethyl-octyl]-[3-(2-methyl-1H-imidazol-3-ium-3-yl)propyl]ammonium Formula: C17H35N3O+2 MolecularWeight: 297.4793

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](C=CN1)CCC[NH2+]CCC(C)CCCC(C)(C)O

Isomeric SMILES

CC1=[N+](C=CN1)CCC[NH2+]CC[C@@H](C)CCCC(C)(C)O

InChI

InChI=1S/C17H33N3O/c1-15(7-5-9-17(3,4)21)8-11-18-10-6-13-20-14-12-19-16(20)2/h12,14-15,18,21H,5-11,13H2,1-4H3/p+2/t15-/m0/s1