N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-2-(4-nitrophenyl)-5-phenyl-pyrazole-3-carboxamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-2-(4-nitrophenyl)-5-phenyl-pyrazole-3-carboxamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-2-(4-nitrophenyl)-5-phenyl-pyrazole-3-carboxamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-2-(4-nitrophenyl)-5-phenyl-3-pyrazolecarboxamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-2-(4-nitrophenyl)-5-phenylpyrazole-3-carboxamide Traditional Name: N-homoveratryl-N-methyl-2-(4-nitrophenyl)-5-phenyl-pyrazole-3-carboxamide Formula: C27H26N4O5 MolecularWeight: 486.51914

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC1=CC(=C(C=C1)OC)OC)C(=O)C2=CC(=NN2C3=CC=C(C=C3)[N+](=O)[O-])C4=CC=CC=C4

Isomeric SMILES

CN(CCC1=CC(=C(C=C1)OC)OC)C(=O)C2=CC(=NN2C3=CC=C(C=C3)[N+](=O)[O-])C4=CC=CC=C4

InChI

InChI=1S/C27H26N4O5/c1-29(16-15-19-9-14-25(35-2)26(17-19)36-3)27(32)24-18-23(20-7-5-4-6-8-20)28-30(24)21-10-12-22(13-11-21)31(33)34/h4-14,17-18H,15-16H2,1-3H3