1-[[5-(4-bromophenyl)furan-2-yl]methyl]-4-(6-nitropyridin-3-yl)piperazine

Systemtic Name: 1-[[5-(4-bromophenyl)furan-2-yl]methyl]-4-(6-nitropyridin-3-yl)piperazine Openeye Name: 1-[[5-(4-bromophenyl)-2-furyl]methyl]-4-(6-nitro-3-pyridyl)piperazine CAS Name: 1-[[5-(4-bromophenyl)-2-furanyl]methyl]-4-(6-nitro-3-pyridinyl)piperazine IUPAC Name: 1-[[5-(4-bromophenyl)furan-2-yl]methyl]-4-(6-nitropyridin-3-yl)piperazine Traditional Name: 1-[[5-(4-bromophenyl)-2-furyl]methyl]-4-(6-nitro-3-pyridyl)piperazine Formula: C20H19BrN4O3 MolecularWeight: 443.29386

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=C(O2)C3=CC=C(C=C3)Br)C4=CN=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1CC2=CC=C(O2)C3=CC=C(C=C3)Br)C4=CN=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H19BrN4O3/c21-16-3-1-15(2-4-16)19-7-6-18(28-19)14-23-9-11-24(12-10-23)17-5-8-20(22-13-17)25(26)27/h1-8,13H,9-12,14H2