ethyl 2-(1,3-benzodioxol-5-yl)-7-methoxy-4-oxidanylidene-1H-quinoline-3-carboxylate

Systemtic Name: ethyl 2-(1,3-benzodioxol-5-yl)-7-methoxy-4-oxidanylidene-1H-quinoline-3-carboxylate Openeye Name: ethyl 2-(1,3-benzodioxol-5-yl)-7-methoxy-4-oxo-1H-quinoline-3-carboxylate CAS Name: 2-(1,3-benzodioxol-5-yl)-7-methoxy-4-oxo-1H-quinoline-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-(1,3-benzodioxol-5-yl)-7-methoxy-4-oxo-1H-quinoline-3-carboxylate Traditional Name: 2-(1,3-benzodioxol-5-yl)-4-keto-7-methoxy-1H-quinoline-3-carboxylic acid ethyl ester Formula: C20H17NO6 MolecularWeight: 367.35208

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC2=C(C1=O)C=CC(=C2)OC)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCOC(=O)C1=C(NC2=C(C1=O)C=CC(=C2)OC)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C20H17NO6/c1-3-25-20(23)17-18(11-4-7-15-16(8-11)27-10-26-15)21-14-9-12(24-2)5-6-13(14)19(17)22/h4-9H,3,10H2,1-2H3,(H,21,22)