4-(3,4-dimethoxyphenyl)-N-[2-[(2-nitrophenyl)amino]ethyl]-1-phenyl-pyrazole-3-carboxamide

Systemtic Name: 4-(3,4-dimethoxyphenyl)-N-[2-[(2-nitrophenyl)amino]ethyl]-1-phenyl-pyrazole-3-carboxamide Openeye Name: 4-(3,4-dimethoxyphenyl)-N-[2-(2-nitroanilino)ethyl]-1-phenyl-pyrazole-3-carboxamide CAS Name: 4-(3,4-dimethoxyphenyl)-N-[2-(2-nitroanilino)ethyl]-1-phenyl-3-pyrazolecarboxamide IUPAC Name: 4-(3,4-dimethoxyphenyl)-N-[2-(2-nitroanilino)ethyl]-1-phenylpyrazole-3-carboxamide Traditional Name: 4-(3,4-dimethoxyphenyl)-N-[2-(2-nitroanilino)ethyl]-1-phenyl-pyrazole-3-carboxamide Formula: C26H25N5O5 MolecularWeight: 487.5072

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CN(N=C2C(=O)NCCNC3=CC=CC=C3[N+](=O)[O-])C4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CN(N=C2C(=O)NCCNC3=CC=CC=C3[N+](=O)[O-])C4=CC=CC=C4)OC

InChI

InChI=1S/C26H25N5O5/c1-35-23-13-12-18(16-24(23)36-2)20-17-30(19-8-4-3-5-9-19)29-25(20)26(32)28-15-14-27-21-10-6-7-11-22(21)31(33)34/h3-13,16-17,27H,14-15H2,1-2H3,(H,28,32)