methyl 2-(1,3-benzodioxol-5-ylcarbonyloxymethyl)-4-methyl-quinoline-3-carboxylate

Systemtic Name: methyl 2-(1,3-benzodioxol-5-ylcarbonyloxymethyl)-4-methyl-quinoline-3-carboxylate Openeye Name: methyl 2-(1,3-benzodioxole-5-carbonyloxymethyl)-4-methyl-quinoline-3-carboxylate CAS Name: 2-[[1,3-benzodioxol-5-yl(oxo)methoxy]methyl]-4-methyl-3-quinolinecarboxylic acid methyl ester IUPAC Name: methyl 2-(1,3-benzodioxole-5-carbonyloxymethyl)-4-methylquinoline-3-carboxylate Traditional Name: 4-methyl-2-(piperonyloyloxymethyl)quinoline-3-carboxylic acid methyl ester Formula: C21H17NO6 MolecularWeight: 379.36278

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC2=CC=CC=C12)COC(=O)C3=CC4=C(C=C3)OCO4)C(=O)OC

Isomeric SMILES

CC1=C(C(=NC2=CC=CC=C12)COC(=O)C3=CC4=C(C=C3)OCO4)C(=O)OC

InChI

InChI=1S/C21H17NO6/c1-12-14-5-3-4-6-15(14)22-16(19(12)21(24)25-2)10-26-20(23)13-7-8-17-18(9-13)28-11-27-17/h3-9H,10-11H2,1-2H3