[4-[(4,5-dimethoxy-2-nitro-phenyl)methyl]piperazin-1-yl]-(3,4,5-trimethoxyphenyl)methanone

Systemtic Name: [4-[(4,5-dimethoxy-2-nitro-phenyl)methyl]piperazin-1-yl]-(3,4,5-trimethoxyphenyl)methanone Openeye Name: [4-[(4,5-dimethoxy-2-nitro-phenyl)methyl]piperazin-1-yl]-(3,4,5-trimethoxyphenyl)methanone CAS Name: [4-[(4,5-dimethoxy-2-nitrophenyl)methyl]-1-piperazinyl]-(3,4,5-trimethoxyphenyl)methanone IUPAC Name: [4-[(4,5-dimethoxy-2-nitrophenyl)methyl]piperazin-1-yl]-(3,4,5-trimethoxyphenyl)methanone Traditional Name: [4-(4,5-dimethoxy-2-nitro-benzyl)piperazino]-(3,4,5-trimethoxyphenyl)methanone Formula: C23H29N3O8 MolecularWeight: 475.49166

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)N2CCN(CC2)CC3=CC(=C(C=C3[N+](=O)[O-])OC)OC

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)N2CCN(CC2)CC3=CC(=C(C=C3[N+](=O)[O-])OC)OC

InChI

InChI=1S/C23H29N3O8/c1-30-18-12-16(17(26(28)29)13-19(18)31-2)14-24-6-8-25(9-7-24)23(27)15-10-20(32-3)22(34-5)21(11-15)33-4/h10-13H,6-9,14H2,1-5H3