3-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-oxidanyl-7-oxidanylidene-5,6,8,8a-tetrahydrochromene-2-carboxylate

Systemtic Name: 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-oxidanyl-7-oxidanylidene-5,6,8,8a-tetrahydrochromene-2-carboxylate Openeye Name: 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-hydroxy-7-oxo-5,6,8,8a-tetrahydrochromene-2-carboxylate CAS Name: 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-hydroxy-7-oxo-5,6,8,8a-tetrahydro-1-benzopyran-2-carboxylate IUPAC Name: 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-hydroxy-7-oxo-5,6,8,8a-tetrahydrochromene-2-carboxylate Traditional Name: 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-hydroxy-7-keto-5,6,8,8a-tetrahydrochromene-2-carboxylate Formula: C18H15O7- MolecularWeight: 343.3075

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C(=C(OC2CC1=O)C(=O)[O-])C3=CC4=C(C=C3)OCCO4)O

Isomeric SMILES

C1CC2=C(C(=C(OC2CC1=O)C(=O)[O-])C3=CC4=C(C=C3)OCCO4)O

InChI

InChI=1S/C18H16O7/c19-10-2-3-11-13(8-10)25-17(18(21)22)15(16(11)20)9-1-4-12-14(7-9)24-6-5-23-12/h1,4,7,13,20H,2-3,5-6,8H2,(H,21,22)/p-1