[3-[(4-bromanyl-3-methyl-phenyl)amino]-3-oxidanylidene-propyl]-ethyl-(2-methylprop-2-enyl)azanium

Systemtic Name: [3-[(4-bromanyl-3-methyl-phenyl)amino]-3-oxidanylidene-propyl]-ethyl-(2-methylprop-2-enyl)azanium Openeye Name: [3-(4-bromo-3-methyl-anilino)-3-oxo-propyl]-ethyl-(2-methylallyl)ammonium CAS Name: [3-(4-bromo-3-methylanilino)-3-oxopropyl]-ethyl-(2-methylprop-2-enyl)ammonium IUPAC Name: [3-(4-bromo-3-methylanilino)-3-oxopropyl]-ethyl-(2-methylprop-2-enyl)azanium Traditional Name: [3-(4-bromo-3-methyl-anilino)-3-keto-propyl]-ethyl-(2-methylallyl)ammonium Formula: C16H24BrN2O+ MolecularWeight: 340.27856

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CCC(=O)NC1=CC(=C(C=C1)Br)C)CC(=C)C

Isomeric SMILES

CC[NH+](CCC(=O)NC1=CC(=C(C=C1)Br)C)CC(=C)C

InChI

InChI=1S/C16H23BrN2O/c1-5-19(11-12(2)3)9-8-16(20)18-14-6-7-15(17)13(4)10-14/h6-7,10H,2,5,8-9,11H2,1,3-4H3,(H,18,20)/p+1