2-[2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)ethanoylamino]-N-(4-methoxyphenyl)benzamide

Systemtic Name: 2-[2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)ethanoylamino]-N-(4-methoxyphenyl)benzamide Openeye Name: 2-[[2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)acetyl]amino]-N-(4-methoxyphenyl)benzamide CAS Name: 2-[[2-(3,5-dimethyl-4-nitro-1-pyrazolyl)-1-oxoethyl]amino]-N-(4-methoxyphenyl)benzamide IUPAC Name: 2-[[2-(3,5-dimethyl-4-nitropyrazol-1-yl)acetyl]amino]-N-(4-methoxyphenyl)benzamide Traditional Name: 2-[[2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)acetyl]amino]-N-(4-methoxyphenyl)benzamide Formula: C21H21N5O5 MolecularWeight: 423.42194

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC(=O)NC2=CC=CC=C2C(=O)NC3=CC=C(C=C3)OC)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CC(=O)NC2=CC=CC=C2C(=O)NC3=CC=C(C=C3)OC)C)[N+](=O)[O-]

InChI

InChI=1S/C21H21N5O5/c1-13-20(26(29)30)14(2)25(24-13)12-19(27)23-18-7-5-4-6-17(18)21(28)22-15-8-10-16(31-3)11-9-15/h4-11H,12H2,1-3H3,(H,22,28)(H,23,27)