N-[4-[2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)ethanoyl]phenyl]butanamide

Systemtic Name: N-[4-[2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)ethanoyl]phenyl]butanamide Openeye Name: N-[4-[2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)acetyl]phenyl]butanamide CAS Name: N-[4-[2-(3,5-dimethyl-4-nitro-1-pyrazolyl)-1-oxoethyl]phenyl]butanamide IUPAC Name: N-[4-[2-(3,5-dimethyl-4-nitropyrazol-1-yl)acetyl]phenyl]butanamide Traditional Name: N-[4-[2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)acetyl]phenyl]butyramide Formula: C17H20N4O4 MolecularWeight: 344.3651

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=CC=C(C=C1)C(=O)CN2C(=C(C(=N2)C)[N+](=O)[O-])C

Isomeric SMILES

CCCC(=O)NC1=CC=C(C=C1)C(=O)CN2C(=C(C(=N2)C)[N+](=O)[O-])C

InChI

InChI=1S/C17H20N4O4/c1-4-5-16(23)18-14-8-6-13(7-9-14)15(22)10-20-12(3)17(21(24)25)11(2)19-20/h6-9H,4-5,10H2,1-3H3,(H,18,23)