[2-[(4-bromanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-[(5-ethanoyl-2-methoxy-phenyl)methyl]-methyl-azanium

Systemtic Name: [2-[(4-bromanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-[(5-ethanoyl-2-methoxy-phenyl)methyl]-methyl-azanium Openeye Name: (5-acetyl-2-methoxy-phenyl)methyl-[2-(4-bromo-2-methyl-anilino)-2-oxo-ethyl]-methyl-ammonium CAS Name: (5-acetyl-2-methoxyphenyl)methyl-[2-(4-bromo-2-methylanilino)-2-oxoethyl]-methylammonium IUPAC Name: (5-acetyl-2-methoxyphenyl)methyl-[2-(4-bromo-2-methylanilino)-2-oxoethyl]-methylazanium Traditional Name: (5-acetyl-2-methoxy-benzyl)-[2-(4-bromo-2-methyl-anilino)-2-keto-ethyl]-methyl-ammonium Formula: C20H24BrN2O3+ MolecularWeight: 420.32016

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(=O)C[NH+](C)CC2=C(C=CC(=C2)C(=O)C)OC

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=O)C[NH+](C)CC2=C(C=CC(=C2)C(=O)C)OC

InChI

InChI=1S/C20H23BrN2O3/c1-13-9-17(21)6-7-18(13)22-20(25)12-23(3)11-16-10-15(14(2)24)5-8-19(16)26-4/h5-10H,11-12H2,1-4H3,(H,22,25)/p+1