1-(2,3-dimethylphenyl)-4-methyl-5-(2-nitrophenoxy)-N-propyl-pyrazole-3-carboxamide

Systemtic Name: 1-(2,3-dimethylphenyl)-4-methyl-5-(2-nitrophenoxy)-N-propyl-pyrazole-3-carboxamide Openeye Name: 1-(2,3-dimethylphenyl)-4-methyl-5-(2-nitrophenoxy)-N-propyl-pyrazole-3-carboxamide CAS Name: 1-(2,3-dimethylphenyl)-4-methyl-5-(2-nitrophenoxy)-N-propyl-3-pyrazolecarboxamide IUPAC Name: 1-(2,3-dimethylphenyl)-4-methyl-5-(2-nitrophenoxy)-N-propylpyrazole-3-carboxamide Traditional Name: 1-(2,3-dimethylphenyl)-4-methyl-5-(2-nitrophenoxy)-N-propyl-pyrazole-3-carboxamide Formula: C22H24N4O4 MolecularWeight: 408.45036

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C1=NN(C(=C1C)OC2=CC=CC=C2[N+](=O)[O-])C3=CC=CC(=C3C)C

Isomeric SMILES

CCCNC(=O)C1=NN(C(=C1C)OC2=CC=CC=C2[N+](=O)[O-])C3=CC=CC(=C3C)C

InChI

InChI=1S/C22H24N4O4/c1-5-13-23-21(27)20-16(4)22(30-19-12-7-6-10-18(19)26(28)29)25(24-20)17-11-8-9-14(2)15(17)3/h6-12H,5,13H2,1-4H3,(H,23,27)