N-[2-(2,5-dimethoxyphenyl)ethyl]-1-(4-nitrophenyl)-5-piperidin-4-yl-pyrazole-4-carboxamide

Systemtic Name: N-[2-(2,5-dimethoxyphenyl)ethyl]-1-(4-nitrophenyl)-5-piperidin-4-yl-pyrazole-4-carboxamide Openeye Name: N-[2-(2,5-dimethoxyphenyl)ethyl]-1-(4-nitrophenyl)-5-(4-piperidyl)pyrazole-4-carboxamide CAS Name: N-[2-(2,5-dimethoxyphenyl)ethyl]-1-(4-nitrophenyl)-5-(4-piperidinyl)-4-pyrazolecarboxamide IUPAC Name: N-[2-(2,5-dimethoxyphenyl)ethyl]-1-(4-nitrophenyl)-5-piperidin-4-ylpyrazole-4-carboxamide Traditional Name: N-[2-(2,5-dimethoxyphenyl)ethyl]-1-(4-nitrophenyl)-5-(4-piperidyl)pyrazole-4-carboxamide Formula: C25H29N5O5 MolecularWeight: 479.52826

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)CCNC(=O)C2=C(N(N=C2)C3=CC=C(C=C3)[N+](=O)[O-])C4CCNCC4

Isomeric SMILES

COC1=CC(=C(C=C1)OC)CCNC(=O)C2=C(N(N=C2)C3=CC=C(C=C3)[N+](=O)[O-])C4CCNCC4

InChI

InChI=1S/C25H29N5O5/c1-34-21-7-8-23(35-2)18(15-21)11-14-27-25(31)22-16-28-29(24(22)17-9-12-26-13-10-17)19-3-5-20(6-4-19)30(32)33/h3-8,15-17,26H,9-14H2,1-2H3,(H,27,31)