[2-[(3-bromanyl-4-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-cyclopropyl-[(4-methoxyphenyl)methyl]azanium

Systemtic Name: [2-[(3-bromanyl-4-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-cyclopropyl-[(4-methoxyphenyl)methyl]azanium Openeye Name: [2-(3-bromo-4-methyl-anilino)-2-oxo-ethyl]-cyclopropyl-[(4-methoxyphenyl)methyl]ammonium CAS Name: [2-(3-bromo-4-methylanilino)-2-oxoethyl]-cyclopropyl-[(4-methoxyphenyl)methyl]ammonium IUPAC Name: [2-(3-bromo-4-methylanilino)-2-oxoethyl]-cyclopropyl-[(4-methoxyphenyl)methyl]azanium Traditional Name: [2-(3-bromo-4-methyl-anilino)-2-keto-ethyl]-cyclopropyl-p-anisyl-ammonium Formula: C20H24BrN2O2+ MolecularWeight: 404.32076

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C[NH+](CC2=CC=C(C=C2)OC)C3CC3)Br

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C[NH+](CC2=CC=C(C=C2)OC)C3CC3)Br

InChI

InChI=1S/C20H23BrN2O2/c1-14-3-6-16(11-19(14)21)22-20(24)13-23(17-7-8-17)12-15-4-9-18(25-2)10-5-15/h3-6,9-11,17H,7-8,12-13H2,1-2H3,(H,22,24)/p+1