5,7-bis(oxidanyl)-2-phenyl-4,6,7,7a-tetrahydro-3aH-1,3-benzodioxole-5-carboxylate

Systemtic Name: 5,7-bis(oxidanyl)-2-phenyl-4,6,7,7a-tetrahydro-3aH-1,3-benzodioxole-5-carboxylate Openeye Name: 5,7-dihydroxy-2-phenyl-4,6,7,7a-tetrahydro-3aH-1,3-benzodioxole-5-carboxylate CAS Name: 5,7-dihydroxy-2-phenyl-4,6,7,7a-tetrahydro-3aH-1,3-benzodioxole-5-carboxylate IUPAC Name: 5,7-dihydroxy-2-phenyl-4,6,7,7a-tetrahydro-3aH-1,3-benzodioxole-5-carboxylate Traditional Name: 5,7-dihydroxy-2-phenyl-4,6,7,7a-tetrahydro-3aH-1,3-benzodioxole-5-carboxylate Formula: C14H15O6- MolecularWeight: 279.2653

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C2C(CC1(C(=O)[O-])O)OC(O2)C3=CC=CC=C3)O

Isomeric SMILES

C1C(C2C(CC1(C(=O)[O-])O)OC(O2)C3=CC=CC=C3)O

InChI

InChI=1S/C14H16O6/c15-9-6-14(18,13(16)17)7-10-11(9)20-12(19-10)8-4-2-1-3-5-8/h1-5,9-12,15,18H,6-7H2,(H,16,17)/p-1