(4-bromophenyl)methyl-[2-(2-cyanoethylamino)-2-oxidanylidene-ethyl]-cyclopropyl-azanium

Systemtic Name: (4-bromophenyl)methyl-[2-(2-cyanoethylamino)-2-oxidanylidene-ethyl]-cyclopropyl-azanium Openeye Name: (4-bromophenyl)methyl-[2-(2-cyanoethylamino)-2-oxo-ethyl]-cyclopropyl-ammonium CAS Name: (4-bromophenyl)methyl-[2-(2-cyanoethylamino)-2-oxoethyl]-cyclopropylammonium IUPAC Name: (4-bromophenyl)methyl-[2-(2-cyanoethylamino)-2-oxoethyl]-cyclopropylazanium Traditional Name: (4-bromobenzyl)-[2-(2-cyanoethylamino)-2-keto-ethyl]-cyclopropyl-ammonium Formula: C15H19BrN3O+ MolecularWeight: 337.23486

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1[NH+](CC2=CC=C(C=C2)Br)CC(=O)NCCC#N

Isomeric SMILES

C1CC1[NH+](CC2=CC=C(C=C2)Br)CC(=O)NCCC#N

InChI

InChI=1S/C15H18BrN3O/c16-13-4-2-12(3-5-13)10-19(14-6-7-14)11-15(20)18-9-1-8-17/h2-5,14H,1,6-7,9-11H2,(H,18,20)/p+1