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

Systemtic Name: [2-[(2-bromanyl-4-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-methyl-(naphthalen-2-ylmethyl)azanium Openeye Name: [2-(2-bromo-4-methyl-anilino)-2-oxo-ethyl]-methyl-(2-naphthylmethyl)ammonium CAS Name: [2-(2-bromo-4-methylanilino)-2-oxoethyl]-methyl-(2-naphthalenylmethyl)ammonium IUPAC Name: [2-(2-bromo-4-methylanilino)-2-oxoethyl]-methyl-(naphthalen-2-ylmethyl)azanium Traditional Name: [2-(2-bromo-4-methyl-anilino)-2-keto-ethyl]-methyl-(2-naphthylmethyl)ammonium Formula: C21H22BrN2O+ MolecularWeight: 398.31618

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C[NH+](C)CC2=CC3=CC=CC=C3C=C2)Br

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)C[NH+](C)CC2=CC3=CC=CC=C3C=C2)Br

InChI

InChI=1S/C21H21BrN2O/c1-15-7-10-20(19(22)11-15)23-21(25)14-24(2)13-16-8-9-17-5-3-4-6-18(17)12-16/h3-12H,13-14H2,1-2H3,(H,23,25)/p+1