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

Systemtic Name: [2-[(4-bromanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-[(2-cyanophenyl)methyl]-methyl-azanium Openeye Name: [2-(4-bromo-2-methyl-anilino)-2-oxo-ethyl]-[(2-cyanophenyl)methyl]-methyl-ammonium CAS Name: [2-(4-bromo-2-methylanilino)-2-oxoethyl]-[(2-cyanophenyl)methyl]-methylammonium IUPAC Name: [2-(4-bromo-2-methylanilino)-2-oxoethyl]-[(2-cyanophenyl)methyl]-methylazanium Traditional Name: [2-(4-bromo-2-methyl-anilino)-2-keto-ethyl]-(2-cyanobenzyl)-methyl-ammonium Formula: C18H19BrN3O+ MolecularWeight: 373.26696

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(=O)C[NH+](C)CC2=CC=CC=C2C#N

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=O)C[NH+](C)CC2=CC=CC=C2C#N

InChI

InChI=1S/C18H18BrN3O/c1-13-9-16(19)7-8-17(13)21-18(23)12-22(2)11-15-6-4-3-5-14(15)10-20/h3-9H,11-12H2,1-2H3,(H,21,23)/p+1