[2-[(4-bromanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-methyl-phenethyl-azanium

Systemtic Name: [2-[(4-bromanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-methyl-phenethyl-azanium Openeye Name: [2-(4-bromo-2-methyl-anilino)-2-oxo-ethyl]-methyl-phenethyl-ammonium CAS Name: [2-(4-bromo-2-methylanilino)-2-oxoethyl]-methyl-phenethylammonium IUPAC Name: [2-(4-bromo-2-methylanilino)-2-oxoethyl]-methyl-phenethylazanium Traditional Name: [2-(4-bromo-2-methyl-anilino)-2-keto-ethyl]-methyl-phenethyl-ammonium Formula: C18H22BrN2O+ MolecularWeight: 362.28408

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(=O)C[NH+](C)CCC2=CC=CC=C2

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=O)C[NH+](C)CCC2=CC=CC=C2

InChI

InChI=1S/C18H21BrN2O/c1-14-12-16(19)8-9-17(14)20-18(22)13-21(2)11-10-15-6-4-3-5-7-15/h3-9,12H,10-11,13H2,1-2H3,(H,20,22)/p+1