N-(2,6-dimethylphenyl)-3-(3-nitropyrazol-1-yl)propanamide

Systemtic Name: N-(2,6-dimethylphenyl)-3-(3-nitropyrazol-1-yl)propanamide Openeye Name: N-(2,6-dimethylphenyl)-3-(3-nitropyrazol-1-yl)propanamide CAS Name: N-(2,6-dimethylphenyl)-3-(3-nitro-1-pyrazolyl)propanamide IUPAC Name: N-(2,6-dimethylphenyl)-3-(3-nitropyrazol-1-yl)propanamide Traditional Name: N-(2,6-dimethylphenyl)-3-(3-nitropyrazol-1-yl)propionamide Formula: C14H16N4O3 MolecularWeight: 288.30184

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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