N-(2,5-dimethylphenyl)-3-(3-nitropyrazol-1-yl)propanamide

Systemtic Name: N-(2,5-dimethylphenyl)-3-(3-nitropyrazol-1-yl)propanamide Openeye Name: N-(2,5-dimethylphenyl)-3-(3-nitropyrazol-1-yl)propanamide CAS Name: N-(2,5-dimethylphenyl)-3-(3-nitro-1-pyrazolyl)propanamide IUPAC Name: N-(2,5-dimethylphenyl)-3-(3-nitropyrazol-1-yl)propanamide Traditional Name: N-(2,5-dimethylphenyl)-3-(3-nitropyrazol-1-yl)propionamide Formula: C14H16N4O3 MolecularWeight: 288.30184

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC(=O)CCN2C=CC(=N2)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC(=O)CCN2C=CC(=N2)[N+](=O)[O-]

InChI

InChI=1S/C14H16N4O3/c1-10-3-4-11(2)12(9-10)15-14(19)6-8-17-7-5-13(16-17)18(20)21/h3-5,7,9H,6,8H2,1-2H3,(H,15,19)