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

Systemtic Name: ethyl 1-(4-nitrophenyl)-4-[2-oxidanylidene-2-[(3-propan-2-ylphenyl)amino]ethoxy]pyrazole-3-carboxylate Openeye Name: ethyl 4-[2-(3-isopropylanilino)-2-oxo-ethoxy]-1-(4-nitrophenyl)pyrazole-3-carboxylate CAS Name: 1-(4-nitrophenyl)-4-[2-oxo-2-(3-propan-2-ylanilino)ethoxy]-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(4-nitrophenyl)-4-[2-oxo-2-(3-propan-2-ylanilino)ethoxy]pyrazole-3-carboxylate Traditional Name: 4-[2-(3-isopropylanilino)-2-keto-ethoxy]-1-(4-nitrophenyl)pyrazole-3-carboxylic acid ethyl ester Formula: C23H24N4O6 MolecularWeight: 452.45986

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C=C1OCC(=O)NC2=CC=CC(=C2)C(C)C)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=NN(C=C1OCC(=O)NC2=CC=CC(=C2)C(C)C)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C23H24N4O6/c1-4-32-23(29)22-20(13-26(25-22)18-8-10-19(11-9-18)27(30)31)33-14-21(28)24-17-7-5-6-16(12-17)15(2)3/h5-13,15H,4,14H2,1-3H3,(H,24,28)