4-dibenzofuran-2-yl-2-(dodecanoylamino)-4-oxidanylidene-butanoic acid

Systemtic Name: 4-dibenzofuran-2-yl-2-(dodecanoylamino)-4-oxidanylidene-butanoic acid Openeye Name: 4-dibenzofuran-2-yl-2-(dodecanoylamino)-4-oxo-butanoic acid CAS Name: 4-(2-dibenzofuranyl)-4-oxo-2-(1-oxododecylamino)butanoic acid IUPAC Name: 4-dibenzofuran-2-yl-2-(dodecanoylamino)-4-oxobutanoic acid Traditional Name: 4-dibenzofuran-2-yl-4-keto-2-(lauroylamino)butyric acid Formula: C28H35NO5 MolecularWeight: 465.5812

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)NC(CC(=O)C1=CC2=C(C=C1)OC3=CC=CC=C32)C(=O)O

Isomeric SMILES

CCCCCCCCCCCC(=O)NC(CC(=O)C1=CC2=C(C=C1)OC3=CC=CC=C32)C(=O)O

InChI

InChI=1S/C28H35NO5/c1-2-3-4-5-6-7-8-9-10-15-27(31)29-23(28(32)33)19-24(30)20-16-17-26-22(18-20)21-13-11-12-14-25(21)34-26/h11-14,16-18,23H,2-10,15,19H2,1H3,(H,29,31)(H,32,33)