methyl 4-[2-(2,3-dihydroindol-1-yl)-2-oxidanylidene-ethoxy]-1-phenyl-pyrazole-3-carboxylate

Systemtic Name: methyl 4-[2-(2,3-dihydroindol-1-yl)-2-oxidanylidene-ethoxy]-1-phenyl-pyrazole-3-carboxylate Openeye Name: methyl 4-(2-indolin-1-yl-2-oxo-ethoxy)-1-phenyl-pyrazole-3-carboxylate CAS Name: 4-[2-(2,3-dihydroindol-1-yl)-2-oxoethoxy]-1-phenyl-3-pyrazolecarboxylic acid methyl ester IUPAC Name: methyl 4-[2-(2,3-dihydroindol-1-yl)-2-oxoethoxy]-1-phenylpyrazole-3-carboxylate Traditional Name: 4-(2-indolin-1-yl-2-keto-ethoxy)-1-phenyl-pyrazole-3-carboxylic acid methyl ester Formula: C21H19N3O4 MolecularWeight: 377.39326

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=NN(C=C1OCC(=O)N2CCC3=CC=CC=C32)C4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=NN(C=C1OCC(=O)N2CCC3=CC=CC=C32)C4=CC=CC=C4

InChI

InChI=1S/C21H19N3O4/c1-27-21(26)20-18(13-24(22-20)16-8-3-2-4-9-16)28-14-19(25)23-12-11-15-7-5-6-10-17(15)23/h2-10,13H,11-12,14H2,1H3