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

Systemtic Name: (4-imidazol-1-yl-3-nitro-phenyl)-[4-[(4-methoxyphenyl)methyl]piperazin-1-yl]methanone Openeye Name: (4-imidazol-1-yl-3-nitro-phenyl)-[4-[(4-methoxyphenyl)methyl]piperazin-1-yl]methanone CAS Name: [4-(1-imidazolyl)-3-nitrophenyl]-[4-[(4-methoxyphenyl)methyl]-1-piperazinyl]methanone IUPAC Name: (4-imidazol-1-yl-3-nitrophenyl)-[4-[(4-methoxyphenyl)methyl]piperazin-1-yl]methanone Traditional Name: (4-imidazol-1-yl-3-nitro-phenyl)-(4-p-anisylpiperazino)methanone Formula: C22H23N5O4 MolecularWeight: 421.44912

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN2CCN(CC2)C(=O)C3=CC(=C(C=C3)N4C=CN=C4)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)CN2CCN(CC2)C(=O)C3=CC(=C(C=C3)N4C=CN=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H23N5O4/c1-31-19-5-2-17(3-6-19)15-24-10-12-25(13-11-24)22(28)18-4-7-20(21(14-18)27(29)30)26-9-8-23-16-26/h2-9,14,16H,10-13,15H2,1H3