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

Systemtic Name: (4-methylphenyl)-[4-(3,4,5-trimethoxy-2-nitro-phenyl)carbonylpiperazin-1-yl]methanone Openeye Name: p-tolyl-[4-(3,4,5-trimethoxy-2-nitro-benzoyl)piperazin-1-yl]methanone CAS Name: (4-methylphenyl)-[4-[oxo-(3,4,5-trimethoxy-2-nitrophenyl)methyl]-1-piperazinyl]methanone IUPAC Name: (4-methylphenyl)-[4-(3,4,5-trimethoxy-2-nitrobenzoyl)piperazin-1-yl]methanone Traditional Name: p-tolyl-[4-(3,4,5-trimethoxy-2-nitro-benzoyl)piperazino]methanone Formula: C22H25N3O7 MolecularWeight: 443.4498

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N2CCN(CC2)C(=O)C3=CC(=C(C(=C3[N+](=O)[O-])OC)OC)OC

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N2CCN(CC2)C(=O)C3=CC(=C(C(=C3[N+](=O)[O-])OC)OC)OC

InChI

InChI=1S/C22H25N3O7/c1-14-5-7-15(8-6-14)21(26)23-9-11-24(12-10-23)22(27)16-13-17(30-2)19(31-3)20(32-4)18(16)25(28)29/h5-8,13H,9-12H2,1-4H3