[2-(furan-2-yl)-6,8-dimethyl-4-oxidanylidene-chromen-3-yl] 5-bromanylpyridine-3-carboxylate

Systemtic Name: [2-(furan-2-yl)-6,8-dimethyl-4-oxidanylidene-chromen-3-yl] 5-bromanylpyridine-3-carboxylate Openeye Name: [2-(2-furyl)-6,8-dimethyl-4-oxo-chromen-3-yl] 5-bromopyridine-3-carboxylate CAS Name: 5-bromo-3-pyridinecarboxylic acid [2-(2-furanyl)-6,8-dimethyl-4-oxo-1-benzopyran-3-yl] ester IUPAC Name: [2-(furan-2-yl)-6,8-dimethyl-4-oxochromen-3-yl] 5-bromopyridine-3-carboxylate Traditional Name: 5-bromonicotinic acid [2-(2-furyl)-4-keto-6,8-dimethyl-chromen-3-yl] ester Formula: C21H14BrNO5 MolecularWeight: 440.24356

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C(=O)C(=C(O2)C3=CC=CO3)OC(=O)C4=CC(=CN=C4)Br)C

Isomeric SMILES

CC1=CC(=C2C(=C1)C(=O)C(=C(O2)C3=CC=CO3)OC(=O)C4=CC(=CN=C4)Br)C

InChI

InChI=1S/C21H14BrNO5/c1-11-6-12(2)18-15(7-11)17(24)20(19(27-18)16-4-3-5-26-16)28-21(25)13-8-14(22)10-23-9-13/h3-10H,1-2H3