3-(2-bromanyl-4,5-dimethyl-phenyl)-2-oxidanyl-6-pyridin-3-yl-pyran-4-one

Systemtic Name: 3-(2-bromanyl-4,5-dimethyl-phenyl)-2-oxidanyl-6-pyridin-3-yl-pyran-4-one Openeye Name: 3-(2-bromo-4,5-dimethyl-phenyl)-2-hydroxy-6-(3-pyridyl)pyran-4-one CAS Name: 3-(2-bromo-4,5-dimethylphenyl)-2-hydroxy-6-(3-pyridinyl)-4-pyranone IUPAC Name: 3-(2-bromo-4,5-dimethylphenyl)-2-hydroxy-6-pyridin-3-ylpyran-4-one Traditional Name: 3-(2-bromo-4,5-dimethyl-phenyl)-2-hydroxy-6-(3-pyridyl)pyran-4-one Formula: C18H14BrNO3 MolecularWeight: 372.21266

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C(=C1)C2=C(OC(=CC2=O)C3=CN=CC=C3)O)Br)C

Isomeric SMILES

CC1=C(C=C(C(=C1)C2=C(OC(=CC2=O)C3=CN=CC=C3)O)Br)C

InChI

InChI=1S/C18H14BrNO3/c1-10-6-13(14(19)7-11(10)2)17-15(21)8-16(23-18(17)22)12-4-3-5-20-9-12/h3-9,22H,1-2H3