ethyl 1-(4-nitrophenyl)-4-[2-oxidanylidene-2-(4-phenylpiperazin-1-yl)ethoxy]pyrazole-3-carboxylate

Systemtic Name: ethyl 1-(4-nitrophenyl)-4-[2-oxidanylidene-2-(4-phenylpiperazin-1-yl)ethoxy]pyrazole-3-carboxylate Openeye Name: ethyl 1-(4-nitrophenyl)-4-[2-oxo-2-(4-phenylpiperazin-1-yl)ethoxy]pyrazole-3-carboxylate CAS Name: 1-(4-nitrophenyl)-4-[2-oxo-2-(4-phenyl-1-piperazinyl)ethoxy]-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(4-nitrophenyl)-4-[2-oxo-2-(4-phenylpiperazin-1-yl)ethoxy]pyrazole-3-carboxylate Traditional Name: 4-[2-keto-2-(4-phenylpiperazino)ethoxy]-1-(4-nitrophenyl)pyrazole-3-carboxylic acid ethyl ester Formula: C24H25N5O6 MolecularWeight: 479.4852

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C=C1OCC(=O)N2CCN(CC2)C3=CC=CC=C3)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=NN(C=C1OCC(=O)N2CCN(CC2)C3=CC=CC=C3)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C24H25N5O6/c1-2-34-24(31)23-21(16-28(25-23)19-8-10-20(11-9-19)29(32)33)35-17-22(30)27-14-12-26(13-15-27)18-6-4-3-5-7-18/h3-11,16H,2,12-15,17H2,1H3