N-(2,5-dimethylphenyl)-2-(4-nitropyrazol-1-yl)butanamide

Systemtic Name: N-(2,5-dimethylphenyl)-2-(4-nitropyrazol-1-yl)butanamide Openeye Name: N-(2,5-dimethylphenyl)-2-(4-nitropyrazol-1-yl)butanamide CAS Name: N-(2,5-dimethylphenyl)-2-(4-nitro-1-pyrazolyl)butanamide IUPAC Name: N-(2,5-dimethylphenyl)-2-(4-nitropyrazol-1-yl)butanamide Traditional Name: N-(2,5-dimethylphenyl)-2-(4-nitropyrazol-1-yl)butyramide Formula: C15H18N4O3 MolecularWeight: 302.32842

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=C(C=CC(=C1)C)C)N2C=C(C=N2)[N+](=O)[O-]

Isomeric SMILES

CCC(C(=O)NC1=C(C=CC(=C1)C)C)N2C=C(C=N2)[N+](=O)[O-]

InChI

InChI=1S/C15H18N4O3/c1-4-14(18-9-12(8-16-18)19(21)22)15(20)17-13-7-10(2)5-6-11(13)3/h5-9,14H,4H2,1-3H3,(H,17,20)