N-[2-methyl-5-(propanoylamino)phenyl]-1-(3-nitrophenyl)pyrazole-3-carboxamide

Systemtic Name: N-[2-methyl-5-(propanoylamino)phenyl]-1-(3-nitrophenyl)pyrazole-3-carboxamide Openeye Name: N-[2-methyl-5-(propanoylamino)phenyl]-1-(3-nitrophenyl)pyrazole-3-carboxamide CAS Name: N-[2-methyl-5-(1-oxopropylamino)phenyl]-1-(3-nitrophenyl)-3-pyrazolecarboxamide IUPAC Name: N-[2-methyl-5-(propanoylamino)phenyl]-1-(3-nitrophenyl)pyrazole-3-carboxamide Traditional Name: N-(2-methyl-5-propionamido-phenyl)-1-(3-nitrophenyl)pyrazole-3-carboxamide Formula: C20H19N5O4 MolecularWeight: 393.39596

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC(=C(C=C1)C)NC(=O)C2=NN(C=C2)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CCC(=O)NC1=CC(=C(C=C1)C)NC(=O)C2=NN(C=C2)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H19N5O4/c1-3-19(26)21-14-8-7-13(2)18(11-14)22-20(27)17-9-10-24(23-17)15-5-4-6-16(12-15)25(28)29/h4-12H,3H2,1-2H3,(H,21,26)(H,22,27)