[2-methyl-5-(1-methylpyrrol-2-yl)pyrazol-3-yl]-[4-(4-nitrophenyl)piperazin-1-yl]methanone

Systemtic Name: [2-methyl-5-(1-methylpyrrol-2-yl)pyrazol-3-yl]-[4-(4-nitrophenyl)piperazin-1-yl]methanone Openeye Name: [2-methyl-5-(1-methylpyrrol-2-yl)pyrazol-3-yl]-[4-(4-nitrophenyl)piperazin-1-yl]methanone CAS Name: [2-methyl-5-(1-methyl-2-pyrrolyl)-3-pyrazolyl]-[4-(4-nitrophenyl)-1-piperazinyl]methanone IUPAC Name: [2-methyl-5-(1-methylpyrrol-2-yl)pyrazol-3-yl]-[4-(4-nitrophenyl)piperazin-1-yl]methanone Traditional Name: [2-methyl-5-(1-methylpyrrol-2-yl)pyrazol-3-yl]-[4-(4-nitrophenyl)piperazino]methanone Formula: C20H22N6O3 MolecularWeight: 394.42708

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1C2=NN(C(=C2)C(=O)N3CCN(CC3)C4=CC=C(C=C4)[N+](=O)[O-])C

Isomeric SMILES

CN1C=CC=C1C2=NN(C(=C2)C(=O)N3CCN(CC3)C4=CC=C(C=C4)[N+](=O)[O-])C

InChI

InChI=1S/C20H22N6O3/c1-22-9-3-4-18(22)17-14-19(23(2)21-17)20(27)25-12-10-24(11-13-25)15-5-7-16(8-6-15)26(28)29/h3-9,14H,10-13H2,1-2H3