(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)methyl-ethyl-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]azanium

Systemtic Name: (6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)methyl-ethyl-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]azanium Openeye Name: (6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methyl-ethyl-[2-(isopropylamino)-2-oxo-ethyl]ammonium CAS Name: (6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methyl-ethyl-[2-oxo-2-(propan-2-ylamino)ethyl]ammonium IUPAC Name: (6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methyl-ethyl-[2-oxo-2-(propan-2-ylamino)ethyl]azanium Traditional Name: (6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methyl-ethyl-[2-(isopropylamino)-2-keto-ethyl]ammonium Formula: C16H24BrN2O3+ MolecularWeight: 372.27736

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC1=CC2=C(C=C1Br)OCCO2)CC(=O)NC(C)C

Isomeric SMILES

CC[NH+](CC1=CC2=C(C=C1Br)OCCO2)CC(=O)NC(C)C

InChI

InChI=1S/C16H23BrN2O3/c1-4-19(10-16(20)18-11(2)3)9-12-7-14-15(8-13(12)17)22-6-5-21-14/h7-8,11H,4-6,9-10H2,1-3H3,(H,18,20)/p+1