[3-bromanyl-5-methoxy-4-[2-[(2-methylphenyl)amino]-2-oxidanylidene-ethoxy]phenyl]methyl-phenethyl-azanium

Systemtic Name: [3-bromanyl-5-methoxy-4-[2-[(2-methylphenyl)amino]-2-oxidanylidene-ethoxy]phenyl]methyl-phenethyl-azanium Openeye Name: [3-bromo-5-methoxy-4-[2-(2-methylanilino)-2-oxo-ethoxy]phenyl]methyl-phenethyl-ammonium CAS Name: [3-bromo-5-methoxy-4-[2-(2-methylanilino)-2-oxoethoxy]phenyl]methyl-phenethylammonium IUPAC Name: [3-bromo-5-methoxy-4-[2-(2-methylanilino)-2-oxoethoxy]phenyl]methyl-phenethylazanium Traditional Name: [3-bromo-4-[2-keto-2-(o-toluidino)ethoxy]-5-methoxy-benzyl]-phenethyl-ammonium Formula: C25H28BrN2O3+ MolecularWeight: 484.40542

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)COC2=C(C=C(C=C2Br)C[NH2+]CCC3=CC=CC=C3)OC

Isomeric SMILES

CC1=CC=CC=C1NC(=O)COC2=C(C=C(C=C2Br)C[NH2+]CCC3=CC=CC=C3)OC

InChI

InChI=1S/C25H27BrN2O3/c1-18-8-6-7-11-22(18)28-24(29)17-31-25-21(26)14-20(15-23(25)30-2)16-27-13-12-19-9-4-3-5-10-19/h3-11,14-15,27H,12-13,16-17H2,1-2H3,(H,28,29)/p+1