[2-[(3-bromophenyl)amino]-2-oxidanylidene-ethyl]-(2-cyanoethyl)-methyl-azanium

Systemtic Name: [2-[(3-bromophenyl)amino]-2-oxidanylidene-ethyl]-(2-cyanoethyl)-methyl-azanium Openeye Name: [2-(3-bromoanilino)-2-oxo-ethyl]-(2-cyanoethyl)-methyl-ammonium CAS Name: [2-(3-bromoanilino)-2-oxoethyl]-(2-cyanoethyl)-methylammonium IUPAC Name: [2-(3-bromoanilino)-2-oxoethyl]-(2-cyanoethyl)-methylazanium Traditional Name: [2-(3-bromoanilino)-2-keto-ethyl]-(2-cyanoethyl)-methyl-ammonium Formula: C12H15BrN3O+ MolecularWeight: 297.171

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCC#N)CC(=O)NC1=CC(=CC=C1)Br

Isomeric SMILES

C[NH+](CCC#N)CC(=O)NC1=CC(=CC=C1)Br

InChI

InChI=1S/C12H14BrN3O/c1-16(7-3-6-14)9-12(17)15-11-5-2-4-10(13)8-11/h2,4-5,8H,3,7,9H2,1H3,(H,15,17)/p+1