(7,8-dimethyl-2-oxidanylidene-chromen-4-yl)methyl 5-bromanylpyridine-3-carboxylate

Systemtic Name: (7,8-dimethyl-2-oxidanylidene-chromen-4-yl)methyl 5-bromanylpyridine-3-carboxylate Openeye Name: (7,8-dimethyl-2-oxo-chromen-4-yl)methyl 5-bromopyridine-3-carboxylate CAS Name: 5-bromo-3-pyridinecarboxylic acid (7,8-dimethyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7,8-dimethyl-2-oxochromen-4-yl)methyl 5-bromopyridine-3-carboxylate Traditional Name: 5-bromonicotinic acid (2-keto-7,8-dimethyl-chromen-4-yl)methyl ester Formula: C18H14BrNO4 MolecularWeight: 388.21206

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)C(=CC(=O)O2)COC(=O)C3=CC(=CN=C3)Br)C

Isomeric SMILES

CC1=C(C2=C(C=C1)C(=CC(=O)O2)COC(=O)C3=CC(=CN=C3)Br)C

InChI

InChI=1S/C18H14BrNO4/c1-10-3-4-15-13(6-16(21)24-17(15)11(10)2)9-23-18(22)12-5-14(19)8-20-7-12/h3-8H,9H2,1-2H3