[3-(3-methoxyphenyl)-1H-pyrazol-5-yl]-[4-(4-nitrophenyl)piperazin-1-yl]methanone

Systemtic Name: [3-(3-methoxyphenyl)-1H-pyrazol-5-yl]-[4-(4-nitrophenyl)piperazin-1-yl]methanone Openeye Name: [3-(3-methoxyphenyl)-1H-pyrazol-5-yl]-[4-(4-nitrophenyl)piperazin-1-yl]methanone CAS Name: [3-(3-methoxyphenyl)-1H-pyrazol-5-yl]-[4-(4-nitrophenyl)-1-piperazinyl]methanone IUPAC Name: [3-(3-methoxyphenyl)-1H-pyrazol-5-yl]-[4-(4-nitrophenyl)piperazin-1-yl]methanone Traditional Name: [3-(3-methoxyphenyl)-1H-pyrazol-5-yl]-[4-(4-nitrophenyl)piperazino]methanone Formula: C21H21N5O4 MolecularWeight: 407.42254

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=NNC(=C2)C(=O)N3CCN(CC3)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=CC(=C1)C2=NNC(=C2)C(=O)N3CCN(CC3)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H21N5O4/c1-30-18-4-2-3-15(13-18)19-14-20(23-22-19)21(27)25-11-9-24(10-12-25)16-5-7-17(8-6-16)26(28)29/h2-8,13-14H,9-12H2,1H3,(H,22,23)