3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-N-(2-methyl-3-nitro-phenyl)propanamide

Systemtic Name: 3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-N-(2-methyl-3-nitro-phenyl)propanamide Openeye Name: 3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-N-(2-methyl-3-nitro-phenyl)propanamide CAS Name: 3-(3,5-dimethyl-1-phenyl-4-pyrazolyl)-N-(2-methyl-3-nitrophenyl)propanamide IUPAC Name: 3-(3,5-dimethyl-1-phenylpyrazol-4-yl)-N-(2-methyl-3-nitrophenyl)propanamide Traditional Name: 3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-N-(2-methyl-3-nitro-phenyl)propionamide Formula: C21H22N4O3 MolecularWeight: 378.42438

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])NC(=O)CCC2=C(N(N=C2C)C3=CC=CC=C3)C

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])NC(=O)CCC2=C(N(N=C2C)C3=CC=CC=C3)C

InChI

InChI=1S/C21H22N4O3/c1-14-19(10-7-11-20(14)25(27)28)22-21(26)13-12-18-15(2)23-24(16(18)3)17-8-5-4-6-9-17/h4-11H,12-13H2,1-3H3,(H,22,26)