3-[2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxycarbonyl-methyl-amino]-2-oxidanylidene-ethanoyl]oxybenzoic acid

Systemtic Name: 3-[2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxycarbonyl-methyl-amino]-2-oxidanylidene-ethanoyl]oxybenzoic acid Openeye Name: 3-[2-[(2,2-dimethyl-3H-benzofuran-7-yl)oxycarbonyl-methyl-amino]-2-oxo-acetyl]oxybenzoic acid CAS Name: 3-[2-[[(2,2-dimethyl-3H-benzofuran-7-yl)oxy-oxomethyl]-methylamino]-1,2-dioxoethoxy]benzoic acid IUPAC Name: 3-[2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxycarbonyl-methylamino]-2-oxoacetyl]oxybenzoic acid Traditional Name: 3-[2-[(2,2-dimethylcoumaran-7-yl)oxycarbonyl-methyl-amino]-2-keto-acetyl]oxybenzoic acid Formula: C21H19NO8 MolecularWeight: 413.37746

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(O1)C(=CC=C2)OC(=O)N(C)C(=O)C(=O)OC3=CC=CC(=C3)C(=O)O)C

Isomeric SMILES

CC1(CC2=C(O1)C(=CC=C2)OC(=O)N(C)C(=O)C(=O)OC3=CC=CC(=C3)C(=O)O)C

InChI

InChI=1S/C21H19NO8/c1-21(2)11-13-7-5-9-15(16(13)30-21)29-20(27)22(3)17(23)19(26)28-14-8-4-6-12(10-14)18(24)25/h4-10H,11H2,1-3H3,(H,24,25)