N-(3-hydroxyphenyl)-2-(4-nitropyrazol-1-yl)butanamide

Systemtic Name: N-(3-hydroxyphenyl)-2-(4-nitropyrazol-1-yl)butanamide Openeye Name: N-(3-hydroxyphenyl)-2-(4-nitropyrazol-1-yl)butanamide CAS Name: N-(3-hydroxyphenyl)-2-(4-nitro-1-pyrazolyl)butanamide IUPAC Name: N-(3-hydroxyphenyl)-2-(4-nitropyrazol-1-yl)butanamide Traditional Name: N-(3-hydroxyphenyl)-2-(4-nitropyrazol-1-yl)butyramide Formula: C13H14N4O4 MolecularWeight: 290.27466

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H14N4O4/c1-2-12(16-8-10(7-14-16)17(20)21)13(19)15-9-4-3-5-11(18)6-9/h3-8,12,18H,2H2,1H3,(H,15,19)