[4-(4-nitro-3-piperidin-1-yl-phenyl)piperazin-1-yl]-(3,4,5-trimethoxyphenyl)methanone

Systemtic Name: [4-(4-nitro-3-piperidin-1-yl-phenyl)piperazin-1-yl]-(3,4,5-trimethoxyphenyl)methanone Openeye Name: [4-[4-nitro-3-(1-piperidyl)phenyl]piperazin-1-yl]-(3,4,5-trimethoxyphenyl)methanone CAS Name: [4-[4-nitro-3-(1-piperidinyl)phenyl]-1-piperazinyl]-(3,4,5-trimethoxyphenyl)methanone IUPAC Name: [4-(4-nitro-3-piperidin-1-ylphenyl)piperazin-1-yl]-(3,4,5-trimethoxyphenyl)methanone Traditional Name: [4-(4-nitro-3-piperidino-phenyl)piperazino]-(3,4,5-trimethoxyphenyl)methanone Formula: C25H32N4O6 MolecularWeight: 484.54478

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)N2CCN(CC2)C3=CC(=C(C=C3)[N+](=O)[O-])N4CCCCC4

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)N2CCN(CC2)C3=CC(=C(C=C3)[N+](=O)[O-])N4CCCCC4

InChI

InChI=1S/C25H32N4O6/c1-33-22-15-18(16-23(34-2)24(22)35-3)25(30)28-13-11-26(12-14-28)19-7-8-20(29(31)32)21(17-19)27-9-5-4-6-10-27/h7-8,15-17H,4-6,9-14H2,1-3H3