N-[1-(4-methylphenyl)propyl]-2-(4-nitropyrazol-1-yl)butanamide

Systemtic Name: N-[1-(4-methylphenyl)propyl]-2-(4-nitropyrazol-1-yl)butanamide Openeye Name: 2-(4-nitropyrazol-1-yl)-N-[1-(p-tolyl)propyl]butanamide CAS Name: N-[1-(4-methylphenyl)propyl]-2-(4-nitro-1-pyrazolyl)butanamide IUPAC Name: N-[1-(4-methylphenyl)propyl]-2-(4-nitropyrazol-1-yl)butanamide Traditional Name: 2-(4-nitropyrazol-1-yl)-N-[1-(p-tolyl)propyl]butyramide Formula: C17H22N4O3 MolecularWeight: 330.38158

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H22N4O3/c1-4-15(13-8-6-12(3)7-9-13)19-17(22)16(5-2)20-11-14(10-18-20)21(23)24/h6-11,15-16H,4-5H2,1-3H3,(H,19,22)