(5-bromanylthiophen-2-yl)methyl-[2-[(3,4-dimethoxyphenyl)amino]-2-oxidanylidene-ethyl]-methyl-azanium

Systemtic Name: (5-bromanylthiophen-2-yl)methyl-[2-[(3,4-dimethoxyphenyl)amino]-2-oxidanylidene-ethyl]-methyl-azanium Openeye Name: (5-bromo-2-thienyl)methyl-[2-(3,4-dimethoxyanilino)-2-oxo-ethyl]-methyl-ammonium CAS Name: (5-bromo-2-thiophenyl)methyl-[2-(3,4-dimethoxyanilino)-2-oxoethyl]-methylammonium IUPAC Name: (5-bromothiophen-2-yl)methyl-[2-(3,4-dimethoxyanilino)-2-oxoethyl]-methylazanium Traditional Name: (5-bromo-2-thienyl)methyl-[2-(3,4-dimethoxyanilino)-2-keto-ethyl]-methyl-ammonium Formula: C16H20BrN2O3S+ MolecularWeight: 400.3106

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=C(S1)Br)CC(=O)NC2=CC(=C(C=C2)OC)OC

Isomeric SMILES

C[NH+](CC1=CC=C(S1)Br)CC(=O)NC2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C16H19BrN2O3S/c1-19(9-12-5-7-15(17)23-12)10-16(20)18-11-4-6-13(21-2)14(8-11)22-3/h4-8H,9-10H2,1-3H3,(H,18,20)/p+1