5-chloranyl-3-(2-methyl-4-prop-2-enoxy-phenyl)-2-oxidanyl-6-pyridin-3-yl-pyran-4-one

Systemtic Name: 5-chloranyl-3-(2-methyl-4-prop-2-enoxy-phenyl)-2-oxidanyl-6-pyridin-3-yl-pyran-4-one Openeye Name: 3-(4-allyloxy-2-methyl-phenyl)-5-chloro-2-hydroxy-6-(3-pyridyl)pyran-4-one CAS Name: 5-chloro-2-hydroxy-3-(2-methyl-4-prop-2-enoxyphenyl)-6-(3-pyridinyl)-4-pyranone IUPAC Name: 5-chloro-2-hydroxy-3-(2-methyl-4-prop-2-enoxyphenyl)-6-pyridin-3-ylpyran-4-one Traditional Name: 3-(4-allyloxy-2-methyl-phenyl)-5-chloro-2-hydroxy-6-(3-pyridyl)pyran-4-one Formula: C20H16ClNO4 MolecularWeight: 369.79834

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCC=C)C2=C(OC(=C(C2=O)Cl)C3=CN=CC=C3)O

Isomeric SMILES

CC1=C(C=CC(=C1)OCC=C)C2=C(OC(=C(C2=O)Cl)C3=CN=CC=C3)O

InChI

InChI=1S/C20H16ClNO4/c1-3-9-25-14-6-7-15(12(2)10-14)16-18(23)17(21)19(26-20(16)24)13-5-4-8-22-11-13/h3-8,10-11,24H,1,9H2,2H3