[(1R,2S)-2-(4-methylpentoxy)cycloheptyl]azanium

Systemtic Name: [(1R,2S)-2-(4-methylpentoxy)cycloheptyl]azanium Openeye Name: [(1R,2S)-2-isohexyloxycycloheptyl]ammonium CAS Name: [(1R,2S)-2-(4-methylpentoxy)cycloheptyl]ammonium IUPAC Name: [(1R,2S)-2-(4-methylpentoxy)cycloheptyl]azanium Traditional Name: [(1R,2S)-2-isohexyloxycycloheptyl]ammonium Formula: C13H28NO+ MolecularWeight: 214.36752

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCOC1CCCCCC1[NH3+]

Isomeric SMILES

CC(C)CCCO[C@H]1CCCCC[C@H]1[NH3+]

InChI

InChI=1S/C13H27NO/c1-11(2)7-6-10-15-13-9-5-3-4-8-12(13)14/h11-13H,3-10,14H2,1-2H3/p+1/t12-,13+/m1/s1