(2-bromophenyl)methyl-[2-(pyridin-3-ylcarbonylamino)ethyl]azanium

Systemtic Name: (2-bromophenyl)methyl-[2-(pyridin-3-ylcarbonylamino)ethyl]azanium Openeye Name: (2-bromophenyl)methyl-[2-(pyridine-3-carbonylamino)ethyl]ammonium CAS Name: (2-bromophenyl)methyl-[2-[[oxo(3-pyridinyl)methyl]amino]ethyl]ammonium IUPAC Name: (2-bromophenyl)methyl-[2-(pyridine-3-carbonylamino)ethyl]azanium Traditional Name: (2-bromobenzyl)-(2-nicotinamidoethyl)ammonium Formula: C15H17BrN3O+ MolecularWeight: 335.21898

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C[NH2+]CCNC(=O)C2=CN=CC=C2)Br

Isomeric SMILES

C1=CC=C(C(=C1)C[NH2+]CCNC(=O)C2=CN=CC=C2)Br

InChI

InChI=1S/C15H16BrN3O/c16-14-6-2-1-4-12(14)10-18-8-9-19-15(20)13-5-3-7-17-11-13/h1-7,11,18H,8-10H2,(H,19,20)/p+1