N-(2-methoxy-5-methyl-phenyl)-3-(4-nitropyrazol-1-yl)propanamide

Systemtic Name: N-(2-methoxy-5-methyl-phenyl)-3-(4-nitropyrazol-1-yl)propanamide Openeye Name: N-(2-methoxy-5-methyl-phenyl)-3-(4-nitropyrazol-1-yl)propanamide CAS Name: N-(2-methoxy-5-methylphenyl)-3-(4-nitro-1-pyrazolyl)propanamide IUPAC Name: N-(2-methoxy-5-methylphenyl)-3-(4-nitropyrazol-1-yl)propanamide Traditional Name: N-(2-methoxy-5-methyl-phenyl)-3-(4-nitropyrazol-1-yl)propionamide Formula: C14H16N4O4 MolecularWeight: 304.30124

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H16N4O4/c1-10-3-4-13(22-2)12(7-10)16-14(19)5-6-17-9-11(8-15-17)18(20)21/h3-4,7-9H,5-6H2,1-2H3,(H,16,19)