2-[3-(5,9-dimethyl-7-oxidanylidene-3-phenyl-furo[3,2-g]chromen-6-yl)propanoylamino]butanoic acid

Systemtic Name: 2-[3-(5,9-dimethyl-7-oxidanylidene-3-phenyl-furo[3,2-g]chromen-6-yl)propanoylamino]butanoic acid Openeye Name: 2-[3-(5,9-dimethyl-7-oxo-3-phenyl-furo[3,2-g]chromen-6-yl)propanoylamino]butanoic acid CAS Name: 2-[[3-(5,9-dimethyl-7-oxo-3-phenyl-6-furo[3,2-g][1]benzopyranyl)-1-oxopropyl]amino]butanoic acid IUPAC Name: 2-[3-(5,9-dimethyl-7-oxo-3-phenylfuro[3,2-g]chromen-6-yl)propanoylamino]butanoic acid Traditional Name: 2-[3-(7-keto-5,9-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(=CO3)C4=CC=CC=C4)C)OC1=O)C

Isomeric SMILES

CCC(C(=O)O)NC(=O)CCC1=C(C2=C(C(=C3C(=C2)C(=CO3)C4=CC=CC=C4)C)OC1=O)C

InChI

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