(5-bromanylthiophen-2-yl)methyl-[2-oxidanylidene-2-[(2,4,6-trimethylphenyl)amino]ethyl]-prop-2-enyl-azanium

Systemtic Name: (5-bromanylthiophen-2-yl)methyl-[2-oxidanylidene-2-[(2,4,6-trimethylphenyl)amino]ethyl]-prop-2-enyl-azanium Openeye Name: allyl-[(5-bromo-2-thienyl)methyl]-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]ammonium CAS Name: (5-bromo-2-thiophenyl)methyl-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]-prop-2-enylammonium IUPAC Name: (5-bromothiophen-2-yl)methyl-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]-prop-2-enylazanium Traditional Name: allyl-[(5-bromo-2-thienyl)methyl]-(2-keto-2-mesidino-ethyl)ammonium Formula: C19H24BrN2OS+ MolecularWeight: 408.37566

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)NC(=O)C[NH+](CC=C)CC2=CC=C(S2)Br)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)NC(=O)C[NH+](CC=C)CC2=CC=C(S2)Br)C

InChI

InChI=1S/C19H23BrN2OS/c1-5-8-22(11-16-6-7-17(20)24-16)12-18(23)21-19-14(3)9-13(2)10-15(19)4/h5-7,9-10H,1,8,11-12H2,2-4H3,(H,21,23)/p+1