(7-bromanyl-2-oxidanylidene-chromen-4-yl)methyl 2-(methoxymethyl)-4-methyl-quinoline-3-carboxylate

Systemtic Name: (7-bromanyl-2-oxidanylidene-chromen-4-yl)methyl 2-(methoxymethyl)-4-methyl-quinoline-3-carboxylate Openeye Name: (7-bromo-2-oxo-chromen-4-yl)methyl 2-(methoxymethyl)-4-methyl-quinoline-3-carboxylate CAS Name: 2-(methoxymethyl)-4-methyl-3-quinolinecarboxylic acid (7-bromo-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-bromo-2-oxochromen-4-yl)methyl 2-(methoxymethyl)-4-methylquinoline-3-carboxylate Traditional Name: 2-(methoxymethyl)-4-methyl-quinoline-3-carboxylic acid (7-bromo-2-keto-chromen-4-yl)methyl ester Formula: C23H18BrNO5 MolecularWeight: 468.29672

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC2=CC=CC=C12)COC)C(=O)OCC3=CC(=O)OC4=C3C=CC(=C4)Br

Isomeric SMILES

CC1=C(C(=NC2=CC=CC=C12)COC)C(=O)OCC3=CC(=O)OC4=C3C=CC(=C4)Br

InChI

InChI=1S/C23H18BrNO5/c1-13-16-5-3-4-6-18(16)25-19(12-28-2)22(13)23(27)29-11-14-9-21(26)30-20-10-15(24)7-8-17(14)20/h3-10H,11-12H2,1-2H3