ethyl 4-[2-(2,3-dihydro-1H-inden-5-yl)-2-oxidanylidene-ethoxy]-1-(4-nitrophenyl)pyrazole-3-carboxylate

Systemtic Name: ethyl 4-[2-(2,3-dihydro-1H-inden-5-yl)-2-oxidanylidene-ethoxy]-1-(4-nitrophenyl)pyrazole-3-carboxylate Openeye Name: ethyl 4-(2-indan-5-yl-2-oxo-ethoxy)-1-(4-nitrophenyl)pyrazole-3-carboxylate CAS Name: 4-[2-(2,3-dihydro-1H-inden-5-yl)-2-oxoethoxy]-1-(4-nitrophenyl)-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-(2,3-dihydro-1H-inden-5-yl)-2-oxoethoxy]-1-(4-nitrophenyl)pyrazole-3-carboxylate Traditional Name: 4-(2-indan-5-yl-2-keto-ethoxy)-1-(4-nitrophenyl)pyrazole-3-carboxylic acid ethyl ester Formula: C23H21N3O6 MolecularWeight: 435.42934

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C=C1OCC(=O)C2=CC3=C(CCC3)C=C2)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=NN(C=C1OCC(=O)C2=CC3=C(CCC3)C=C2)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C23H21N3O6/c1-2-31-23(28)22-21(13-25(24-22)18-8-10-19(11-9-18)26(29)30)32-14-20(27)17-7-6-15-4-3-5-16(15)12-17/h6-13H,2-5,14H2,1H3