(5-bromanylthiophen-2-yl)methyl-[2-[(2-ethyl-6-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-methyl-azanium

Systemtic Name: (5-bromanylthiophen-2-yl)methyl-[2-[(2-ethyl-6-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-methyl-azanium Openeye Name: (5-bromo-2-thienyl)methyl-[2-(2-ethyl-6-methyl-anilino)-2-oxo-ethyl]-methyl-ammonium CAS Name: (5-bromo-2-thiophenyl)methyl-[2-(2-ethyl-6-methylanilino)-2-oxoethyl]-methylammonium IUPAC Name: (5-bromothiophen-2-yl)methyl-[2-(2-ethyl-6-methylanilino)-2-oxoethyl]-methylazanium Traditional Name: (5-bromo-2-thienyl)methyl-[2-(2-ethyl-6-methyl-anilino)-2-keto-ethyl]-methyl-ammonium Formula: C17H22BrN2OS+ MolecularWeight: 382.33838

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=O)C[NH+](C)CC2=CC=C(S2)Br)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=O)C[NH+](C)CC2=CC=C(S2)Br)C

InChI

InChI=1S/C17H21BrN2OS/c1-4-13-7-5-6-12(2)17(13)19-16(21)11-20(3)10-14-8-9-15(18)22-14/h5-9H,4,10-11H2,1-3H3,(H,19,21)/p+1