ethyl 1-[5-(2,4-dimethoxyphenyl)-2-(3-nitrophenyl)pyrazol-3-yl]carbonylpiperidine-4-carboxylate

Systemtic Name: ethyl 1-[5-(2,4-dimethoxyphenyl)-2-(3-nitrophenyl)pyrazol-3-yl]carbonylpiperidine-4-carboxylate Openeye Name: ethyl 1-[5-(2,4-dimethoxyphenyl)-2-(3-nitrophenyl)pyrazole-3-carbonyl]piperidine-4-carboxylate CAS Name: 1-[[5-(2,4-dimethoxyphenyl)-2-(3-nitrophenyl)-3-pyrazolyl]-oxomethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[5-(2,4-dimethoxyphenyl)-2-(3-nitrophenyl)pyrazole-3-carbonyl]piperidine-4-carboxylate Traditional Name: 1-[5-(2,4-dimethoxyphenyl)-2-(3-nitrophenyl)pyrazole-3-carbonyl]isonipecotic acid ethyl ester Formula: C26H28N4O7 MolecularWeight: 508.52312

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)C2=CC(=NN2C3=CC(=CC=C3)[N+](=O)[O-])C4=C(C=C(C=C4)OC)OC

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)C2=CC(=NN2C3=CC(=CC=C3)[N+](=O)[O-])C4=C(C=C(C=C4)OC)OC

InChI

InChI=1S/C26H28N4O7/c1-4-37-26(32)17-10-12-28(13-11-17)25(31)23-16-22(21-9-8-20(35-2)15-24(21)36-3)27-29(23)18-6-5-7-19(14-18)30(33)34/h5-9,14-17H,4,10-13H2,1-3H3