methyl 7-bromanyl-6-methoxy-2-methyl-1,3-bis(oxidanylidene)-4H-isoquinoline-4-carboxylate

Systemtic Name: methyl 7-bromanyl-6-methoxy-2-methyl-1,3-bis(oxidanylidene)-4H-isoquinoline-4-carboxylate Openeye Name: methyl 7-bromo-6-methoxy-2-methyl-1,3-dioxo-4H-isoquinoline-4-carboxylate CAS Name: 7-bromo-6-methoxy-2-methyl-1,3-dioxo-4H-isoquinoline-4-carboxylic acid methyl ester IUPAC Name: methyl 7-bromo-6-methoxy-2-methyl-1,3-dioxo-4H-isoquinoline-4-carboxylate Traditional Name: 7-bromo-1,3-diketo-6-methoxy-2-methyl-4H-isoquinoline-4-carboxylic acid methyl ester Formula: C13H12BrNO5 MolecularWeight: 342.14208

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C(C2=CC(=C(C=C2C1=O)Br)OC)C(=O)OC

Isomeric SMILES

CN1C(=O)C(C2=CC(=C(C=C2C1=O)Br)OC)C(=O)OC

InChI

InChI=1S/C13H12BrNO5/c1-15-11(16)7-4-8(14)9(19-2)5-6(7)10(12(15)17)13(18)20-3/h4-5,10H,1-3H3