(2S)-4-[(2,3-dimethyl-1H-imidazol-3-ium-4-yl)methyl]-2-(4-methylpentyl)morpholine

Systemtic Name: (2S)-4-[(2,3-dimethyl-1H-imidazol-3-ium-4-yl)methyl]-2-(4-methylpentyl)morpholine Openeye Name: (2S)-4-[(2,3-dimethyl-1H-imidazol-3-ium-4-yl)methyl]-2-isohexyl-morpholine CAS Name: (2S)-4-[(2,3-dimethyl-1H-imidazol-3-ium-4-yl)methyl]-2-(4-methylpentyl)morpholine IUPAC Name: (2S)-4-[(2,3-dimethyl-1H-imidazol-3-ium-4-yl)methyl]-2-(4-methylpentyl)morpholine Traditional Name: (2S)-4-[(2,3-dimethyl-1H-imidazol-3-ium-4-yl)methyl]-2-isohexyl-morpholine Formula: C16H30N3O+ MolecularWeight: 280.4289

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](C(=CN1)CN2CCOC(C2)CCCC(C)C)C

Isomeric SMILES

CC1=[N+](C(=CN1)CN2CCO[C@H](C2)CCCC(C)C)C

InChI

InChI=1S/C16H29N3O/c1-13(2)6-5-7-16-12-19(8-9-20-16)11-15-10-17-14(3)18(15)4/h10,13,16H,5-9,11-12H2,1-4H3/p+1/t16-/m0/s1