(4-piperidin-1-ylcarbonylpiperazin-1-yl)-(3,4,5-trimethoxy-2-nitro-phenyl)methanone

Systemtic Name: (4-piperidin-1-ylcarbonylpiperazin-1-yl)-(3,4,5-trimethoxy-2-nitro-phenyl)methanone Openeye Name: [4-(piperidine-1-carbonyl)piperazin-1-yl]-(3,4,5-trimethoxy-2-nitro-phenyl)methanone CAS Name: [4-[oxo(1-piperidinyl)methyl]-1-piperazinyl]-(3,4,5-trimethoxy-2-nitrophenyl)methanone IUPAC Name: [4-(piperidine-1-carbonyl)piperazin-1-yl]-(3,4,5-trimethoxy-2-nitrophenyl)methanone Traditional Name: [4-(piperidine-1-carbonyl)piperazino]-(3,4,5-trimethoxy-2-nitro-phenyl)methanone Formula: C20H28N4O7 MolecularWeight: 436.45892

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C(=C1)C(=O)N2CCN(CC2)C(=O)N3CCCCC3)[N+](=O)[O-])OC)OC

Isomeric SMILES

COC1=C(C(=C(C(=C1)C(=O)N2CCN(CC2)C(=O)N3CCCCC3)[N+](=O)[O-])OC)OC

InChI

InChI=1S/C20H28N4O7/c1-29-15-13-14(16(24(27)28)18(31-3)17(15)30-2)19(25)21-9-11-23(12-10-21)20(26)22-7-5-4-6-8-22/h13H,4-12H2,1-3H3