5-(2,4-dimethoxyphenyl)-2-(3-nitrophenyl)-N-(phenylmethyl)pyrazole-3-carboxamide

Systemtic Name: 5-(2,4-dimethoxyphenyl)-2-(3-nitrophenyl)-N-(phenylmethyl)pyrazole-3-carboxamide Openeye Name: N-benzyl-5-(2,4-dimethoxyphenyl)-2-(3-nitrophenyl)pyrazole-3-carboxamide CAS Name: 5-(2,4-dimethoxyphenyl)-2-(3-nitrophenyl)-N-(phenylmethyl)-3-pyrazolecarboxamide IUPAC Name: N-benzyl-5-(2,4-dimethoxyphenyl)-2-(3-nitrophenyl)pyrazole-3-carboxamide Traditional Name: N-benzyl-5-(2,4-dimethoxyphenyl)-2-(3-nitrophenyl)pyrazole-3-carboxamide Formula: C25H22N4O5 MolecularWeight: 458.46598

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C2=NN(C(=C2)C(=O)NCC3=CC=CC=C3)C4=CC(=CC=C4)[N+](=O)[O-])OC

Isomeric SMILES

COC1=CC(=C(C=C1)C2=NN(C(=C2)C(=O)NCC3=CC=CC=C3)C4=CC(=CC=C4)[N+](=O)[O-])OC

InChI

InChI=1S/C25H22N4O5/c1-33-20-11-12-21(24(14-20)34-2)22-15-23(25(30)26-16-17-7-4-3-5-8-17)28(27-22)18-9-6-10-19(13-18)29(31)32/h3-15H,16H2,1-2H3,(H,26,30)