[4-(4-nitrophenyl)piperazin-1-yl]-(3,4,5-trimethoxy-2-nitro-phenyl)methanone

Systemtic Name: [4-(4-nitrophenyl)piperazin-1-yl]-(3,4,5-trimethoxy-2-nitro-phenyl)methanone Openeye Name: [4-(4-nitrophenyl)piperazin-1-yl]-(3,4,5-trimethoxy-2-nitro-phenyl)methanone CAS Name: [4-(4-nitrophenyl)-1-piperazinyl]-(3,4,5-trimethoxy-2-nitrophenyl)methanone IUPAC Name: [4-(4-nitrophenyl)piperazin-1-yl]-(3,4,5-trimethoxy-2-nitrophenyl)methanone Traditional Name: [4-(4-nitrophenyl)piperazino]-(3,4,5-trimethoxy-2-nitro-phenyl)methanone Formula: C20H22N4O8 MolecularWeight: 446.41068

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C(=C1)C(=O)N2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-])[N+](=O)[O-])OC)OC

Isomeric SMILES

COC1=C(C(=C(C(=C1)C(=O)N2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-])[N+](=O)[O-])OC)OC

InChI

InChI=1S/C20H22N4O8/c1-30-16-12-15(17(24(28)29)19(32-3)18(16)31-2)20(25)22-10-8-21(9-11-22)13-4-6-14(7-5-13)23(26)27/h4-7,12H,8-11H2,1-3H3