N-butan-2-yl-5-(2,4-dimethoxyphenyl)-2-(3-nitrophenyl)pyrazole-3-carboxamide

Systemtic Name: N-butan-2-yl-5-(2,4-dimethoxyphenyl)-2-(3-nitrophenyl)pyrazole-3-carboxamide Openeye Name: 5-(2,4-dimethoxyphenyl)-2-(3-nitrophenyl)-N-sec-butyl-pyrazole-3-carboxamide CAS Name: N-butan-2-yl-5-(2,4-dimethoxyphenyl)-2-(3-nitrophenyl)-3-pyrazolecarboxamide IUPAC Name: N-butan-2-yl-5-(2,4-dimethoxyphenyl)-2-(3-nitrophenyl)pyrazole-3-carboxamide Traditional Name: 5-(2,4-dimethoxyphenyl)-2-(3-nitrophenyl)-N-sec-butyl-pyrazole-3-carboxamide Formula: C22H24N4O5 MolecularWeight: 424.44976

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C1=CC(=NN1C2=CC(=CC=C2)[N+](=O)[O-])C3=C(C=C(C=C3)OC)OC

Isomeric SMILES

CCC(C)NC(=O)C1=CC(=NN1C2=CC(=CC=C2)[N+](=O)[O-])C3=C(C=C(C=C3)OC)OC

InChI

InChI=1S/C22H24N4O5/c1-5-14(2)23-22(27)20-13-19(18-10-9-17(30-3)12-21(18)31-4)24-25(20)15-7-6-8-16(11-15)26(28)29/h6-14H,5H2,1-4H3,(H,23,27)