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

Systemtic Name: methyl 4-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxidanylidene-ethoxy]-1-phenyl-pyrazole-3-carboxylate Openeye Name: methyl 4-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxo-ethoxy]-1-phenyl-pyrazole-3-carboxylate CAS Name: 4-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethoxy]-1-phenyl-3-pyrazolecarboxylic acid methyl ester IUPAC Name: methyl 4-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethoxy]-1-phenylpyrazole-3-carboxylate Traditional Name: 4-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-keto-ethoxy]-1-phenyl-pyrazole-3-carboxylic acid methyl ester Formula: C22H21N3O4 MolecularWeight: 391.41984

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=NN(C=C1OCC(=O)N2CCCC3=CC=CC=C32)C4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=NN(C=C1OCC(=O)N2CCCC3=CC=CC=C32)C4=CC=CC=C4

InChI

InChI=1S/C22H21N3O4/c1-28-22(27)21-19(14-25(23-21)17-10-3-2-4-11-17)29-15-20(26)24-13-7-9-16-8-5-6-12-18(16)24/h2-6,8,10-12,14H,7,9,13,15H2,1H3