2-(2-chlorophenyl)-N-(3-methylbutyl)-5-(4-nitrophenyl)pyrazole-3-carboxamide

Systemtic Name: 2-(2-chlorophenyl)-N-(3-methylbutyl)-5-(4-nitrophenyl)pyrazole-3-carboxamide Openeye Name: 2-(2-chlorophenyl)-N-isopentyl-5-(4-nitrophenyl)pyrazole-3-carboxamide CAS Name: 2-(2-chlorophenyl)-N-(3-methylbutyl)-5-(4-nitrophenyl)-3-pyrazolecarboxamide IUPAC Name: 2-(2-chlorophenyl)-N-(3-methylbutyl)-5-(4-nitrophenyl)pyrazole-3-carboxamide Traditional Name: 2-(2-chlorophenyl)-N-isoamyl-5-(4-nitrophenyl)pyrazole-3-carboxamide Formula: C21H21ClN4O3 MolecularWeight: 412.86944

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)C1=CC(=NN1C2=CC=CC=C2Cl)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)CCNC(=O)C1=CC(=NN1C2=CC=CC=C2Cl)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H21ClN4O3/c1-14(2)11-12-23-21(27)20-13-18(15-7-9-16(10-8-15)26(28)29)24-25(20)19-6-4-3-5-17(19)22/h3-10,13-14H,11-12H2,1-2H3,(H,23,27)