3-(3-methyl-4-nitro-pyrazol-1-yl)-N-[3-(pyrazol-1-ylmethyl)phenyl]propanamide

Systemtic Name: 3-(3-methyl-4-nitro-pyrazol-1-yl)-N-[3-(pyrazol-1-ylmethyl)phenyl]propanamide Openeye Name: 3-(3-methyl-4-nitro-pyrazol-1-yl)-N-[3-(pyrazol-1-ylmethyl)phenyl]propanamide CAS Name: 3-(3-methyl-4-nitro-1-pyrazolyl)-N-[3-(1-pyrazolylmethyl)phenyl]propanamide IUPAC Name: 3-(3-methyl-4-nitropyrazol-1-yl)-N-[3-(pyrazol-1-ylmethyl)phenyl]propanamide Traditional Name: 3-(3-methyl-4-nitro-pyrazol-1-yl)-N-[3-(pyrazol-1-ylmethyl)phenyl]propionamide Formula: C17H18N6O3 MolecularWeight: 354.36322

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1[N+](=O)[O-])CCC(=O)NC2=CC=CC(=C2)CN3C=CC=N3

Isomeric SMILES

CC1=NN(C=C1[N+](=O)[O-])CCC(=O)NC2=CC=CC(=C2)CN3C=CC=N3

InChI

InChI=1S/C17H18N6O3/c1-13-16(23(25)26)12-22(20-13)9-6-17(24)19-15-5-2-4-14(10-15)11-21-8-3-7-18-21/h2-5,7-8,10,12H,6,9,11H2,1H3,(H,19,24)