[(1R)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]-hexyl-azanium

Systemtic Name: [(1R)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]-hexyl-azanium Openeye Name: [(1R)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]-hexyl-ammonium CAS Name: [(1R)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]-hexylammonium IUPAC Name: [(1R)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]-hexylazanium Traditional Name: [(1R)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]-hexyl-ammonium Formula: C17H28NO2+ MolecularWeight: 278.40972

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC[NH2+]C(C)C1=CC2=C(C=C1)OCCCO2

Isomeric SMILES

CCCCCC[NH2+][C@H](C)C1=CC2=C(C=C1)OCCCO2

InChI

InChI=1S/C17H27NO2/c1-3-4-5-6-10-18-14(2)15-8-9-16-17(13-15)20-12-7-11-19-16/h8-9,13-14,18H,3-7,10-12H2,1-2H3/p+1/t14-/m1/s1