[azanyl-[(2-methoxycarbonylphenyl)methylsulfanyl]methylidene]azanium bromide

Systemtic Name: [azanyl-[(2-methoxycarbonylphenyl)methylsulfanyl]methylidene]azanium bromide Openeye Name: [amino-[(2-methoxycarbonylphenyl)methylsulfanyl]methylene]ammonium bromide CAS Name: [amino-[(2-methoxycarbonylphenyl)methylthio]methylidene]ammonium bromide IUPAC Name: [amino-[(2-methoxycarbonylphenyl)methylsulfanyl]methylidene]azanium bromide Traditional Name: [amino-[(2-carbomethoxybenzyl)thio]methylene]ammonium bromide Formula: C10H13BrN2O2S MolecularWeight: 305.19142

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1CSC(=[NH2+])N.[Br-]

Isomeric SMILES

COC(=O)C1=CC=CC=C1CSC(=[NH2+])N.[Br-]

InChI

InChI=1S/C10H12N2O2S.BrH/c1-14-9(13)8-5-3-2-4-7(8)6-15-10(11)12;/h2-5H,6H2,1H3,(H3,11,12);1H