4-[[3-(2-methoxy-2-oxidanylidene-ethyl)-4,8-dimethyl-2-oxidanylidene-chromen-7-yl]oxymethyl]benzoic acid

Systemtic Name: 4-[[3-(2-methoxy-2-oxidanylidene-ethyl)-4,8-dimethyl-2-oxidanylidene-chromen-7-yl]oxymethyl]benzoic acid Openeye Name: 4-[[3-(2-methoxy-2-oxo-ethyl)-4,8-dimethyl-2-oxo-chromen-7-yl]oxymethyl]benzoic acid CAS Name: 4-[[3-(2-methoxy-2-oxoethyl)-4,8-dimethyl-2-oxo-1-benzopyran-7-yl]oxymethyl]benzoic acid IUPAC Name: 4-[[3-(2-methoxy-2-oxoethyl)-4,8-dimethyl-2-oxochromen-7-yl]oxymethyl]benzoic acid Traditional Name: 4-[[2-keto-3-(2-keto-2-methoxy-ethyl)-4,8-dimethyl-chromen-7-yl]oxymethyl]benzoic acid Formula: C22H20O7 MolecularWeight: 396.39

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C=CC(=C2C)OCC3=CC=C(C=C3)C(=O)O)CC(=O)OC

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=CC(=C2C)OCC3=CC=C(C=C3)C(=O)O)CC(=O)OC

InChI

InChI=1S/C22H20O7/c1-12-16-8-9-18(28-11-14-4-6-15(7-5-14)21(24)25)13(2)20(16)29-22(26)17(12)10-19(23)27-3/h4-9H,10-11H2,1-3H3,(H,24,25)