(3,5-dimethoxy-4-oxidanyl-phenyl)-[4-(4-nitrophenyl)piperazin-1-yl]methanone

Systemtic Name: (3,5-dimethoxy-4-oxidanyl-phenyl)-[4-(4-nitrophenyl)piperazin-1-yl]methanone Openeye Name: (4-hydroxy-3,5-dimethoxy-phenyl)-[4-(4-nitrophenyl)piperazin-1-yl]methanone CAS Name: (4-hydroxy-3,5-dimethoxyphenyl)-[4-(4-nitrophenyl)-1-piperazinyl]methanone IUPAC Name: (4-hydroxy-3,5-dimethoxyphenyl)-[4-(4-nitrophenyl)piperazin-1-yl]methanone Traditional Name: (4-hydroxy-3,5-dimethoxy-phenyl)-[4-(4-nitrophenyl)piperazino]methanone Formula: C19H21N3O6 MolecularWeight: 387.38654

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1O)OC)C(=O)N2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=CC(=C1O)OC)C(=O)N2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H21N3O6/c1-27-16-11-13(12-17(28-2)18(16)23)19(24)21-9-7-20(8-10-21)14-3-5-15(6-4-14)22(25)26/h3-6,11-12,23H,7-10H2,1-2H3