O3-ethyl O1-(2-methylpropyl) 8-(acetyloxymethyl)-6-methyl-4-oxidanylidene-quinoline-1,3-dicarboxylate

Systemtic Name: O3-ethyl O1-(2-methylpropyl) 8-(acetyloxymethyl)-6-methyl-4-oxidanylidene-quinoline-1,3-dicarboxylate Openeye Name: O3-ethyl O1-isobutyl 8-(acetoxymethyl)-6-methyl-4-oxo-quinoline-1,3-dicarboxylate CAS Name: 8-(acetyloxymethyl)-6-methyl-4-oxoquinoline-1,3-dicarboxylic acid O3-ethyl ester O1-(2-methylpropyl) ester IUPAC Name: 3-O-ethyl 1-O-(2-methylpropyl) 8-(acetyloxymethyl)-6-methyl-4-oxoquinoline-1,3-dicarboxylate Traditional Name: 8-(acetoxymethyl)-4-keto-6-methyl-quinoline-1,3-dicarboxylic acid O3-ethyl ester O1-isobutyl ester Formula: C21H25NO7 MolecularWeight: 403.4257

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN(C2=C(C=C(C=C2C1=O)C)COC(=O)C)C(=O)OCC(C)C

Isomeric SMILES

CCOC(=O)C1=CN(C2=C(C=C(C=C2C1=O)C)COC(=O)C)C(=O)OCC(C)C

InChI

InChI=1S/C21H25NO7/c1-6-27-20(25)17-9-22(21(26)29-10-12(2)3)18-15(11-28-14(5)23)7-13(4)8-16(18)19(17)24/h7-9,12H,6,10-11H2,1-5H3