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

Systemtic Name: [2-(2,3-dihydro-1H-inden-5-yl)-2-oxidanylidene-ethyl] 4-methoxy-1-phenyl-pyrazole-3-carboxylate Openeye Name: (2-indan-5-yl-2-oxo-ethyl) 4-methoxy-1-phenyl-pyrazole-3-carboxylate CAS Name: 4-methoxy-1-phenyl-3-pyrazolecarboxylic acid [2-(2,3-dihydro-1H-inden-5-yl)-2-oxoethyl] ester IUPAC Name: [2-(2,3-dihydro-1H-inden-5-yl)-2-oxoethyl] 4-methoxy-1-phenylpyrazole-3-carboxylate Traditional Name: 4-methoxy-1-phenyl-pyrazole-3-carboxylic acid (2-indan-5-yl-2-keto-ethyl) ester Formula: C22H20N2O4 MolecularWeight: 376.4052

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CN(N=C1C(=O)OCC(=O)C2=CC3=C(CCC3)C=C2)C4=CC=CC=C4

Isomeric SMILES

COC1=CN(N=C1C(=O)OCC(=O)C2=CC3=C(CCC3)C=C2)C4=CC=CC=C4

InChI

InChI=1S/C22H20N2O4/c1-27-20-13-24(18-8-3-2-4-9-18)23-21(20)22(26)28-14-19(25)17-11-10-15-6-5-7-16(15)12-17/h2-4,8-13H,5-7,14H2,1H3