ethyl 1-(4-nitrophenyl)-4-[2-oxidanylidene-2-[(4-piperidin-1-ylphenyl)amino]ethoxy]pyrazole-3-carboxylate

Systemtic Name: ethyl 1-(4-nitrophenyl)-4-[2-oxidanylidene-2-[(4-piperidin-1-ylphenyl)amino]ethoxy]pyrazole-3-carboxylate Openeye Name: ethyl 1-(4-nitrophenyl)-4-[2-oxo-2-[4-(1-piperidyl)anilino]ethoxy]pyrazole-3-carboxylate CAS Name: 1-(4-nitrophenyl)-4-[2-oxo-2-[4-(1-piperidinyl)anilino]ethoxy]-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(4-nitrophenyl)-4-[2-oxo-2-(4-piperidin-1-ylanilino)ethoxy]pyrazole-3-carboxylate Traditional Name: 4-[2-keto-2-(4-piperidinoanilino)ethoxy]-1-(4-nitrophenyl)pyrazole-3-carboxylic acid ethyl ester Formula: C25H27N5O6 MolecularWeight: 493.51178

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C=C1OCC(=O)NC2=CC=C(C=C2)N3CCCCC3)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=NN(C=C1OCC(=O)NC2=CC=C(C=C2)N3CCCCC3)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C25H27N5O6/c1-2-35-25(32)24-22(16-29(27-24)20-10-12-21(13-11-20)30(33)34)36-17-23(31)26-18-6-8-19(9-7-18)28-14-4-3-5-15-28/h6-13,16H,2-5,14-15,17H2,1H3,(H,26,31)