2-[3-(2,5-dimethyl-7-oxidanylidene-3-phenyl-furo[3,2-g]chromen-6-yl)propanoylamino]butanoic acid

Systemtic Name: 2-[3-(2,5-dimethyl-7-oxidanylidene-3-phenyl-furo[3,2-g]chromen-6-yl)propanoylamino]butanoic acid Openeye Name: 2-[3-(2,5-dimethyl-7-oxo-3-phenyl-furo[3,2-g]chromen-6-yl)propanoylamino]butanoic acid CAS Name: 2-[[3-(2,5-dimethyl-7-oxo-3-phenyl-6-furo[3,2-g][1]benzopyranyl)-1-oxopropyl]amino]butanoic acid IUPAC Name: 2-[3-(2,5-dimethyl-7-oxo-3-phenylfuro[3,2-g]chromen-6-yl)propanoylamino]butanoic acid Traditional Name: 2-[3-(7-keto-2,5-dimethyl-3-phenyl-furo[3,2-g]chromen-6-yl)propanoylamino]butyric acid Formula: C26H25NO6 MolecularWeight: 447.4798

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)O)NC(=O)CCC1=C(C2=C(C=C3C(=C2)C(=C(O3)C)C4=CC=CC=C4)OC1=O)C

Isomeric SMILES

CCC(C(=O)O)NC(=O)CCC1=C(C2=C(C=C3C(=C2)C(=C(O3)C)C4=CC=CC=C4)OC1=O)C

InChI

InChI=1S/C26H25NO6/c1-4-20(25(29)30)27-23(28)11-10-17-14(2)18-12-19-22(13-21(18)33-26(17)31)32-15(3)24(19)16-8-6-5-7-9-16/h5-9,12-13,20H,4,10-11H2,1-3H3,(H,27,28)(H,29,30)