(7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl (3S)-6-chloranyl-3,4-dihydro-2H-chromene-3-carboxylate

Systemtic Name: (7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl (3S)-6-chloranyl-3,4-dihydro-2H-chromene-3-carboxylate Openeye Name: (7-hydroxy-2-oxo-chromen-4-yl)methyl (3S)-6-chlorochromane-3-carboxylate CAS Name: (3S)-6-chloro-3,4-dihydro-2H-1-benzopyran-3-carboxylic acid (7-hydroxy-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-hydroxy-2-oxochromen-4-yl)methyl (3S)-6-chloro-3,4-dihydro-2H-chromene-3-carboxylate Traditional Name: (3S)-6-chlorochroman-3-carboxylic acid (7-hydroxy-2-keto-chromen-4-yl)methyl ester Formula: C20H15ClO6 MolecularWeight: 386.7825

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(COC2=C1C=C(C=C2)Cl)C(=O)OCC3=CC(=O)OC4=C3C=CC(=C4)O

Isomeric SMILES

C1[C@@H](COC2=C1C=C(C=C2)Cl)C(=O)OCC3=CC(=O)OC4=C3C=CC(=C4)O

InChI

InChI=1S/C20H15ClO6/c21-14-1-4-17-11(6-14)5-13(10-25-17)20(24)26-9-12-7-19(23)27-18-8-15(22)2-3-16(12)18/h1-4,6-8,13,22H,5,9-10H2/t13-/m0/s1