ethyl 6-(oxan-4-ylmethyl)-4-oxidanylidene-1H-quinoline-3-carboxylate

Systemtic Name: ethyl 6-(oxan-4-ylmethyl)-4-oxidanylidene-1H-quinoline-3-carboxylate Openeye Name: ethyl 4-oxo-6-(tetrahydropyran-4-ylmethyl)-1H-quinoline-3-carboxylate CAS Name: 6-(4-oxanylmethyl)-4-oxo-1H-quinoline-3-carboxylic acid ethyl ester IUPAC Name: ethyl 6-(oxan-4-ylmethyl)-4-oxo-1H-quinoline-3-carboxylate Traditional Name: 4-keto-6-(tetrahydropyran-4-ylmethyl)-1H-quinoline-3-carboxylic acid ethyl ester Formula: C18H21NO4 MolecularWeight: 315.36364

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CNC2=C(C1=O)C=C(C=C2)CC3CCOCC3

Isomeric SMILES

CCOC(=O)C1=CNC2=C(C1=O)C=C(C=C2)CC3CCOCC3

InChI

InChI=1S/C18H21NO4/c1-2-23-18(21)15-11-19-16-4-3-13(10-14(16)17(15)20)9-12-5-7-22-8-6-12/h3-4,10-12H,2,5-9H2,1H3,(H,19,20)