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

Systemtic Name: methyl 6-bromanyl-2-[(4-bromanyl-2-fluoranyl-phenyl)methyl]-7-methoxy-1,3-bis(oxidanylidene)-4H-isoquinoline-4-carboxylate Openeye Name: methyl 6-bromo-2-[(4-bromo-2-fluoro-phenyl)methyl]-7-methoxy-1,3-dioxo-4H-isoquinoline-4-carboxylate CAS Name: 6-bromo-2-[(4-bromo-2-fluorophenyl)methyl]-7-methoxy-1,3-dioxo-4H-isoquinoline-4-carboxylic acid methyl ester IUPAC Name: methyl 6-bromo-2-[(4-bromo-2-fluorophenyl)methyl]-7-methoxy-1,3-dioxo-4H-isoquinoline-4-carboxylate Traditional Name: 6-bromo-2-(4-bromo-2-fluoro-benzyl)-1,3-diketo-7-methoxy-4H-isoquinoline-4-carboxylic acid methyl ester Formula: C19H14Br2FNO5 MolecularWeight: 515.124563

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(C(=O)N(C(=O)C2=C1)CC3=C(C=C(C=C3)Br)F)C(=O)OC)Br

Isomeric SMILES

COC1=C(C=C2C(C(=O)N(C(=O)C2=C1)CC3=C(C=C(C=C3)Br)F)C(=O)OC)Br

InChI

InChI=1S/C19H14Br2FNO5/c1-27-15-7-12-11(6-13(15)21)16(19(26)28-2)18(25)23(17(12)24)8-9-3-4-10(20)5-14(9)22/h3-7,16H,8H2,1-2H3