3,4-dihydro-2H-1,5-benzodioxepin-7-yl-[2-[methyl(propan-2-yl)amino]-2-oxidanylidene-ethyl]azanium

Systemtic Name: 3,4-dihydro-2H-1,5-benzodioxepin-7-yl-[2-[methyl(propan-2-yl)amino]-2-oxidanylidene-ethyl]azanium Openeye Name: 3,4-dihydro-2H-1,5-benzodioxepin-7-yl-[2-[isopropyl(methyl)amino]-2-oxo-ethyl]ammonium CAS Name: 3,4-dihydro-2H-1,5-benzodioxepin-7-yl-[2-[methyl(propan-2-yl)amino]-2-oxoethyl]ammonium IUPAC Name: 3,4-dihydro-2H-1,5-benzodioxepin-7-yl-[2-[methyl(propan-2-yl)amino]-2-oxoethyl]azanium Traditional Name: 3,4-dihydro-2H-1,5-benzodioxepin-7-yl-[2-[isopropyl(methyl)amino]-2-keto-ethyl]ammonium Formula: C15H23N2O3+ MolecularWeight: 279.35472

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(C)C(=O)C[NH2+]C1=CC2=C(C=C1)OCCCO2

Isomeric SMILES

CC(C)N(C)C(=O)C[NH2+]C1=CC2=C(C=C1)OCCCO2

InChI

InChI=1S/C15H22N2O3/c1-11(2)17(3)15(18)10-16-12-5-6-13-14(9-12)20-8-4-7-19-13/h5-6,9,11,16H,4,7-8,10H2,1-3H3/p+1