(3S,4S)-6,7-dimethoxy-1-oxidanylidene-3-phenyl-3,4-dihydroisochromene-4-carboxylic acid

Systemtic Name: (3S,4S)-6,7-dimethoxy-1-oxidanylidene-3-phenyl-3,4-dihydroisochromene-4-carboxylic acid Openeye Name: (3S,4S)-6,7-dimethoxy-1-oxo-3-phenyl-isochromane-4-carboxylic acid CAS Name: (3S,4S)-6,7-dimethoxy-1-oxo-3-phenyl-3,4-dihydro-1H-2-benzopyran-4-carboxylic acid IUPAC Name: (3S,4S)-6,7-dimethoxy-1-oxo-3-phenyl-3,4-dihydroisochromene-4-carboxylic acid Traditional Name: (3S,4S)-1-keto-6,7-dimethoxy-3-phenyl-isochroman-4-carboxylic acid Formula: C18H16O6 MolecularWeight: 328.31604

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(C(OC2=O)C3=CC=CC=C3)C(=O)O)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)[C@@H]([C@H](OC2=O)C3=CC=CC=C3)C(=O)O)OC

InChI

InChI=1S/C18H16O6/c1-22-13-8-11-12(9-14(13)23-2)18(21)24-16(15(11)17(19)20)10-6-4-3-5-7-10/h3-9,15-16H,1-2H3,(H,19,20)/t15-,16+/m0/s1