N1-(bromomethylbromanuidylmethoxymethyl)-N3-methyl-4-(trioxidanylsulfanyl)benzene-1,3-diamine

Systemtic Name: N1-(bromomethylbromanuidylmethoxymethyl)-N3-methyl-4-(trioxidanylsulfanyl)benzene-1,3-diamine Openeye Name: N1-(bromomethylbromanuidylmethoxymethyl)-N3-methyl-4-(trioxidanylsulfanyl)benzene-1,3-diamine CAS Name: 4-(bromomethylbromanuidylmethoxymethylamino)-2-(methylamino)benzenesulfenic acid hydroperoxy ester IUPAC Name: 1-N-(bromomethylbromanuidylmethoxymethyl)-3-N-methyl-4-(trioxidanylsulfanyl)benzene-1,3-diamine Traditional Name: bromomethylbromanuidylmethoxymethyl-[3-(methylamino)-4-(trioxidanylthio)phenyl]amine Formula: C10H15Br2N2O4S- MolecularWeight: 419.1101

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(C=CC(=C1)NCOC[Br-]CBr)SOOO

Isomeric SMILES

CNC1=C(C=CC(=C1)NCOC[Br-]CBr)SOOO

InChI

InChI=1S/C10H15Br2N2O4S/c1-13-9-4-8(14-7-16-6-12-5-11)2-3-10(9)19-18-17-15/h2-4,13-15H,5-7H2,1H3/q-1