(6,7-dimethyl-2-oxidanylidene-chromen-4-yl)methyl 5-bromanylpyridine-3-carboxylate

Systemtic Name: (6,7-dimethyl-2-oxidanylidene-chromen-4-yl)methyl 5-bromanylpyridine-3-carboxylate Openeye Name: (6,7-dimethyl-2-oxo-chromen-4-yl)methyl 5-bromopyridine-3-carboxylate CAS Name: 5-bromo-3-pyridinecarboxylic acid (6,7-dimethyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (6,7-dimethyl-2-oxochromen-4-yl)methyl 5-bromopyridine-3-carboxylate Traditional Name: 5-bromonicotinic acid (2-keto-6,7-dimethyl-chromen-4-yl)methyl ester Formula: C18H14BrNO4 MolecularWeight: 388.21206

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=CC(=O)O2)COC(=O)C3=CC(=CN=C3)Br)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=CC(=O)O2)COC(=O)C3=CC(=CN=C3)Br)C

InChI

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