[4-[(2-bromophenyl)methyl]piperazin-1-yl]-(3-nitro-1H-pyrazol-5-yl)methanone

Systemtic Name: [4-[(2-bromophenyl)methyl]piperazin-1-yl]-(3-nitro-1H-pyrazol-5-yl)methanone Openeye Name: [4-[(2-bromophenyl)methyl]piperazin-1-yl]-(3-nitro-1H-pyrazol-5-yl)methanone CAS Name: [4-[(2-bromophenyl)methyl]-1-piperazinyl]-(3-nitro-1H-pyrazol-5-yl)methanone IUPAC Name: [4-[(2-bromophenyl)methyl]piperazin-1-yl]-(3-nitro-1H-pyrazol-5-yl)methanone Traditional Name: [4-(2-bromobenzyl)piperazino]-(3-nitro-1H-pyrazol-5-yl)methanone Formula: C15H16BrN5O3 MolecularWeight: 394.22324

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2Br)C(=O)C3=CC(=NN3)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2Br)C(=O)C3=CC(=NN3)[N+](=O)[O-]

InChI

InChI=1S/C15H16BrN5O3/c16-12-4-2-1-3-11(12)10-19-5-7-20(8-6-19)15(22)13-9-14(18-17-13)21(23)24/h1-4,9H,5-8,10H2,(H,17,18)