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

Systemtic Name: (6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)methyl-[2-[(4-bromanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-methyl-azanium Openeye Name: (6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methyl-[2-(4-bromo-2-methyl-anilino)-2-oxo-ethyl]-methyl-ammonium CAS Name: (6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methyl-[2-(4-bromo-2-methylanilino)-2-oxoethyl]-methylammonium IUPAC Name: (6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methyl-[2-(4-bromo-2-methylanilino)-2-oxoethyl]-methylazanium Traditional Name: (6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methyl-[2-(4-bromo-2-methyl-anilino)-2-keto-ethyl]-methyl-ammonium Formula: C19H21Br2N2O3+ MolecularWeight: 485.18964

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(=O)C[NH+](C)CC2=CC3=C(C=C2Br)OCCO3

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=O)C[NH+](C)CC2=CC3=C(C=C2Br)OCCO3

InChI

InChI=1S/C19H20Br2N2O3/c1-12-7-14(20)3-4-16(12)22-19(24)11-23(2)10-13-8-17-18(9-15(13)21)26-6-5-25-17/h3-4,7-9H,5-6,10-11H2,1-2H3,(H,22,24)/p+1