(4-imidazol-1-yl-3-nitro-phenyl)-[4-(2-methoxyphenyl)piperazin-1-yl]methanone

Systemtic Name: (4-imidazol-1-yl-3-nitro-phenyl)-[4-(2-methoxyphenyl)piperazin-1-yl]methanone Openeye Name: (4-imidazol-1-yl-3-nitro-phenyl)-[4-(2-methoxyphenyl)piperazin-1-yl]methanone CAS Name: [4-(1-imidazolyl)-3-nitrophenyl]-[4-(2-methoxyphenyl)-1-piperazinyl]methanone IUPAC Name: (4-imidazol-1-yl-3-nitrophenyl)-[4-(2-methoxyphenyl)piperazin-1-yl]methanone Traditional Name: (4-imidazol-1-yl-3-nitro-phenyl)-[4-(2-methoxyphenyl)piperazino]methanone Formula: C21H21N5O4 MolecularWeight: 407.42254

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCN(CC2)C(=O)C3=CC(=C(C=C3)N4C=CN=C4)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)C(=O)C3=CC(=C(C=C3)N4C=CN=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H21N5O4/c1-30-20-5-3-2-4-18(20)23-10-12-24(13-11-23)21(27)16-6-7-17(19(14-16)26(28)29)25-9-8-22-15-25/h2-9,14-15H,10-13H2,1H3