4-[2-(3,6-diacetyloxy-1-benzofuran-2-yl)ethanoylamino]-2-oxidanyl-benzoic acid

Systemtic Name: 4-[2-(3,6-diacetyloxy-1-benzofuran-2-yl)ethanoylamino]-2-oxidanyl-benzoic acid Openeye Name: 4-[[2-(3,6-diacetoxybenzofuran-2-yl)acetyl]amino]-2-hydroxy-benzoic acid CAS Name: 4-[[2-(3,6-diacetyloxy-2-benzofuranyl)-1-oxoethyl]amino]-2-hydroxybenzoic acid IUPAC Name: 4-[[2-(3,6-diacetyloxy-1-benzofuran-2-yl)acetyl]amino]-2-hydroxybenzoic acid Traditional Name: 4-[[2-(3,6-diacetoxybenzofuran-2-yl)acetyl]amino]-2-hydroxy-benzoic acid Formula: C21H17NO9 MolecularWeight: 427.36098

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC2=C(C=C1)C(=C(O2)CC(=O)NC3=CC(=C(C=C3)C(=O)O)O)OC(=O)C

Isomeric SMILES

CC(=O)OC1=CC2=C(C=C1)C(=C(O2)CC(=O)NC3=CC(=C(C=C3)C(=O)O)O)OC(=O)C

InChI

InChI=1S/C21H17NO9/c1-10(23)29-13-4-6-15-17(8-13)31-18(20(15)30-11(2)24)9-19(26)22-12-3-5-14(21(27)28)16(25)7-12/h3-8,25H,9H2,1-2H3,(H,22,26)(H,27,28)