4-(4-methoxyphenyl)-1-[4-(4-nitrophenyl)piperazin-1-yl]butane-1,2,4-trione

Systemtic Name: 4-(4-methoxyphenyl)-1-[4-(4-nitrophenyl)piperazin-1-yl]butane-1,2,4-trione Openeye Name: 4-(4-methoxyphenyl)-1-[4-(4-nitrophenyl)piperazin-1-yl]butane-1,2,4-trione CAS Name: 4-(4-methoxyphenyl)-1-[4-(4-nitrophenyl)-1-piperazinyl]butane-1,2,4-trione IUPAC Name: 4-(4-methoxyphenyl)-1-[4-(4-nitrophenyl)piperazin-1-yl]butane-1,2,4-trione Traditional Name: 4-(4-methoxyphenyl)-1-[4-(4-nitrophenyl)piperazino]butane-1,2,4-trione Formula: C21H21N3O6 MolecularWeight: 411.40794

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)CC(=O)C(=O)N2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)CC(=O)C(=O)N2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H21N3O6/c1-30-18-8-2-15(3-9-18)19(25)14-20(26)21(27)23-12-10-22(11-13-23)16-4-6-17(7-5-16)24(28)29/h2-9H,10-14H2,1H3