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

Systemtic Name: [(1R)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]-(2-methylbutan-2-yl)azanium Openeye Name: [(1R)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]-(1,1-dimethylpropyl)ammonium CAS Name: [(1R)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]-(2-methylbutan-2-yl)ammonium IUPAC Name: [(1R)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]-(2-methylbutan-2-yl)azanium Traditional Name: tert-amyl-[(1R)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]ammonium Formula: C16H26NO2+ MolecularWeight: 264.38314

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H25NO2/c1-5-16(3,4)17-12(2)13-7-8-14-15(11-13)19-10-6-9-18-14/h7-8,11-12,17H,5-6,9-10H2,1-4H3/p+1/t12-/m1/s1