7-methoxycarbonyl-9-[(2-methylpropan-2-yl)oxycarbonyl]-9H-xanthene-2-carboxylic acid

Systemtic Name: 7-methoxycarbonyl-9-[(2-methylpropan-2-yl)oxycarbonyl]-9H-xanthene-2-carboxylic acid Openeye Name: 9-tert-butoxycarbonyl-7-methoxycarbonyl-9H-xanthene-2-carboxylic acid CAS Name: 7-methoxycarbonyl-9-[(2-methylpropan-2-yl)oxy-oxomethyl]-9H-xanthene-2-carboxylic acid IUPAC Name: 7-methoxycarbonyl-9-[(2-methylpropan-2-yl)oxycarbonyl]-9H-xanthene-2-carboxylic acid Traditional Name: 9-tert-butoxycarbonyl-7-carbomethoxy-9H-xanthene-2-carboxylic acid Formula: C21H20O7 MolecularWeight: 384.3793

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1C2=C(C=CC(=C2)C(=O)O)OC3=C1C=C(C=C3)C(=O)OC

Isomeric SMILES

CC(C)(C)OC(=O)C1C2=C(C=CC(=C2)C(=O)O)OC3=C1C=C(C=C3)C(=O)OC

InChI

InChI=1S/C21H20O7/c1-21(2,3)28-20(25)17-13-9-11(18(22)23)5-7-15(13)27-16-8-6-12(10-14(16)17)19(24)26-4/h5-10,17H,1-4H3,(H,22,23)