N-[3-(2,5-dimethylphenoxy)-5-nitro-phenyl]-3-(3,5-dimethylpyrazol-1-yl)propanamide

Systemtic Name: N-[3-(2,5-dimethylphenoxy)-5-nitro-phenyl]-3-(3,5-dimethylpyrazol-1-yl)propanamide Openeye Name: N-[3-(2,5-dimethylphenoxy)-5-nitro-phenyl]-3-(3,5-dimethylpyrazol-1-yl)propanamide CAS Name: N-[3-(2,5-dimethylphenoxy)-5-nitrophenyl]-3-(3,5-dimethyl-1-pyrazolyl)propanamide IUPAC Name: N-[3-(2,5-dimethylphenoxy)-5-nitrophenyl]-3-(3,5-dimethylpyrazol-1-yl)propanamide Traditional Name: N-[3-(2,5-dimethylphenoxy)-5-nitro-phenyl]-3-(3,5-dimethylpyrazol-1-yl)propionamide Formula: C22H24N4O4 MolecularWeight: 408.45036

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)OC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)CCN3C(=CC(=N3)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)OC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)CCN3C(=CC(=N3)C)C

InChI

InChI=1S/C22H24N4O4/c1-14-5-6-15(2)21(9-14)30-20-12-18(11-19(13-20)26(28)29)23-22(27)7-8-25-17(4)10-16(3)24-25/h5-6,9-13H,7-8H2,1-4H3,(H,23,27)