4-dibenzofuran-2-yl-4-oxidanylidene-2-(2-thiophen-2-ylethanoylamino)butanoic acid

Systemtic Name: 4-dibenzofuran-2-yl-4-oxidanylidene-2-(2-thiophen-2-ylethanoylamino)butanoic acid Openeye Name: 4-dibenzofuran-2-yl-4-oxo-2-[[2-(2-thienyl)acetyl]amino]butanoic acid CAS Name: 4-(2-dibenzofuranyl)-4-oxo-2-[(1-oxo-2-thiophen-2-ylethyl)amino]butanoic acid IUPAC Name: 4-dibenzofuran-2-yl-4-oxo-2-[(2-thiophen-2-ylacetyl)amino]butanoic acid Traditional Name: 4-dibenzofuran-2-yl-4-keto-2-[[2-(2-thienyl)acetyl]amino]butyric acid Formula: C22H17NO5S MolecularWeight: 407.43908

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C3=C(O2)C=CC(=C3)C(=O)CC(C(=O)O)NC(=O)CC4=CC=CS4

Isomeric SMILES

C1=CC=C2C(=C1)C3=C(O2)C=CC(=C3)C(=O)CC(C(=O)O)NC(=O)CC4=CC=CS4

InChI

InChI=1S/C22H17NO5S/c24-18(12-17(22(26)27)23-21(25)11-14-4-3-9-29-14)13-7-8-20-16(10-13)15-5-1-2-6-19(15)28-20/h1-10,17H,11-12H2,(H,23,25)(H,26,27)