3-methoxy-7-oxabicyclo[2.2.1]hepta-1,3,5-triene; 2-oxidanyl-4-propoxy-benzoic acid

Systemtic Name: 3-methoxy-7-oxabicyclo[2.2.1]hepta-1,3,5-triene; 2-oxidanyl-4-propoxy-benzoic acid Openeye Name: 2-hydroxy-4-propoxy-benzoic acid; 3-methoxy-7-oxabicyclo[2.2.1]hepta-1,3,5-triene CAS Name: 2-hydroxy-4-propoxybenzoic acid; 3-methoxy-7-oxabicyclo[2.2.1]hepta-1,3,5-triene IUPAC Name: 2-hydroxy-4-propoxybenzoic acid; 3-methoxy-7-oxabicyclo[2.2.1]hepta-1,3,5-triene Traditional Name: 2-hydroxy-4-propoxy-benzoic acid; 3-methoxy-7-oxabicyclo[2.2.1]hepta-1,3,5-triene Formula: C17H18O6 MolecularWeight: 318.32122

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC(=C(C=C1)C(=O)O)O.COC1=C2C=CC(=C1)O2

Isomeric SMILES

CCCOC1=CC(=C(C=C1)C(=O)O)O.COC1=C2C=CC(=C1)O2

InChI

InChI=1S/C10H12O4.C7H6O2/c1-2-5-14-7-3-4-8(10(12)13)9(11)6-7;1-8-7-4-5-2-3-6(7)9-5/h3-4,6,11H,2,5H2,1H3,(H,12,13);2-4H,1H3