[5-(2,4-dimethoxyphenyl)-2-(4-nitrophenyl)pyrazol-3-yl]-[4-(2-methoxyphenyl)piperazin-1-yl]methanone

Systemtic Name: [5-(2,4-dimethoxyphenyl)-2-(4-nitrophenyl)pyrazol-3-yl]-[4-(2-methoxyphenyl)piperazin-1-yl]methanone Openeye Name: [5-(2,4-dimethoxyphenyl)-2-(4-nitrophenyl)pyrazol-3-yl]-[4-(2-methoxyphenyl)piperazin-1-yl]methanone CAS Name: [5-(2,4-dimethoxyphenyl)-2-(4-nitrophenyl)-3-pyrazolyl]-[4-(2-methoxyphenyl)-1-piperazinyl]methanone IUPAC Name: [5-(2,4-dimethoxyphenyl)-2-(4-nitrophenyl)pyrazol-3-yl]-[4-(2-methoxyphenyl)piperazin-1-yl]methanone Traditional Name: [5-(2,4-dimethoxyphenyl)-2-(4-nitrophenyl)pyrazol-3-yl]-[4-(2-methoxyphenyl)piperazino]methanone Formula: C29H29N5O6 MolecularWeight: 543.57046

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C2=NN(C(=C2)C(=O)N3CCN(CC3)C4=CC=CC=C4OC)C5=CC=C(C=C5)[N+](=O)[O-])OC

Isomeric SMILES

COC1=CC(=C(C=C1)C2=NN(C(=C2)C(=O)N3CCN(CC3)C4=CC=CC=C4OC)C5=CC=C(C=C5)[N+](=O)[O-])OC

InChI

InChI=1S/C29H29N5O6/c1-38-22-12-13-23(28(18-22)40-3)24-19-26(33(30-24)20-8-10-21(11-9-20)34(36)37)29(35)32-16-14-31(15-17-32)25-6-4-5-7-27(25)39-2/h4-13,18-19H,14-17H2,1-3H3