N-[2-(2-methylpropylcarbamoyl)phenyl]-1-(3-nitrophenyl)pyrazole-3-carboxamide

Systemtic Name: N-[2-(2-methylpropylcarbamoyl)phenyl]-1-(3-nitrophenyl)pyrazole-3-carboxamide Openeye Name: N-[2-(isobutylcarbamoyl)phenyl]-1-(3-nitrophenyl)pyrazole-3-carboxamide CAS Name: N-[2-[(2-methylpropylamino)-oxomethyl]phenyl]-1-(3-nitrophenyl)-3-pyrazolecarboxamide IUPAC Name: N-[2-(2-methylpropylcarbamoyl)phenyl]-1-(3-nitrophenyl)pyrazole-3-carboxamide Traditional Name: N-[2-(isobutylcarbamoyl)phenyl]-1-(3-nitrophenyl)pyrazole-3-carboxamide Formula: C21H21N5O4 MolecularWeight: 407.42254

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)C1=CC=CC=C1NC(=O)C2=NN(C=C2)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)CNC(=O)C1=CC=CC=C1NC(=O)C2=NN(C=C2)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H21N5O4/c1-14(2)13-22-20(27)17-8-3-4-9-18(17)23-21(28)19-10-11-25(24-19)15-6-5-7-16(12-15)26(29)30/h3-12,14H,13H2,1-2H3,(H,22,27)(H,23,28)