[2-[[[(E)-3-(5-bromanylthiophen-2-yl)prop-2-enoyl]amino]methyl]phenyl]methyl-dimethyl-azanium

Systemtic Name: [2-[[[(E)-3-(5-bromanylthiophen-2-yl)prop-2-enoyl]amino]methyl]phenyl]methyl-dimethyl-azanium Openeye Name: [2-[[[(E)-3-(5-bromo-2-thienyl)prop-2-enoyl]amino]methyl]phenyl]methyl-dimethyl-ammonium CAS Name: [2-[[[(E)-3-(5-bromo-2-thiophenyl)-1-oxoprop-2-enyl]amino]methyl]phenyl]methyl-dimethylammonium IUPAC Name: [2-[[[(E)-3-(5-bromothiophen-2-yl)prop-2-enoyl]amino]methyl]phenyl]methyl-dimethylazanium Traditional Name: [2-[[[(E)-3-(5-bromo-2-thienyl)acryloyl]amino]methyl]benzyl]-dimethyl-ammonium Formula: C17H20BrN2OS+ MolecularWeight: 380.3225

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CC1=CC=CC=C1CNC(=O)C=CC2=CC=C(S2)Br

Isomeric SMILES

C[NH+](C)CC1=CC=CC=C1CNC(=O)/C=C/C2=CC=C(S2)Br

InChI

InChI=1S/C17H19BrN2OS/c1-20(2)12-14-6-4-3-5-13(14)11-19-17(21)10-8-15-7-9-16(18)22-15/h3-10H,11-12H2,1-2H3,(H,19,21)/p+1/b10-8+