(3S,4S)-3-(furan-2-yl)-1-oxidanylidene-3,4-dihydroisochromene-4-carboxylic acid

Systemtic Name: (3S,4S)-3-(furan-2-yl)-1-oxidanylidene-3,4-dihydroisochromene-4-carboxylic acid Openeye Name: (3S,4S)-3-(2-furyl)-1-oxo-isochromane-4-carboxylic acid CAS Name: (3S,4S)-3-(2-furanyl)-1-oxo-3,4-dihydro-1H-2-benzopyran-4-carboxylic acid IUPAC Name: (3S,4S)-3-(furan-2-yl)-1-oxo-3,4-dihydroisochromene-4-carboxylic acid Traditional Name: (3S,4S)-3-(2-furyl)-1-keto-isochroman-4-carboxylic acid Formula: C14H10O5 MolecularWeight: 258.2262

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(C(OC2=O)C3=CC=CO3)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)[C@@H]([C@H](OC2=O)C3=CC=CO3)C(=O)O

InChI

InChI=1S/C14H10O5/c15-13(16)11-8-4-1-2-5-9(8)14(17)19-12(11)10-6-3-7-18-10/h1-7,11-12H,(H,15,16)/t11-,12+/m0/s1