(4-chloranyl-3-nitro-phenyl)-[4-(4-methoxy-2-nitro-phenyl)piperazin-1-yl]methanone

Systemtic Name: (4-chloranyl-3-nitro-phenyl)-[4-(4-methoxy-2-nitro-phenyl)piperazin-1-yl]methanone Openeye Name: (4-chloro-3-nitro-phenyl)-[4-(4-methoxy-2-nitro-phenyl)piperazin-1-yl]methanone CAS Name: (4-chloro-3-nitrophenyl)-[4-(4-methoxy-2-nitrophenyl)-1-piperazinyl]methanone IUPAC Name: (4-chloro-3-nitrophenyl)-[4-(4-methoxy-2-nitrophenyl)piperazin-1-yl]methanone Traditional Name: (4-chloro-3-nitro-phenyl)-[4-(4-methoxy-2-nitro-phenyl)piperazino]methanone Formula: C18H17ClN4O6 MolecularWeight: 420.80378

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H17ClN4O6/c1-29-13-3-5-15(17(11-13)23(27)28)20-6-8-21(9-7-20)18(24)12-2-4-14(19)16(10-12)22(25)26/h2-5,10-11H,6-9H2,1H3