2-[3-(3-tert-butyl-5-methyl-7-oxidanylidene-furo[3,2-g]chromen-6-yl)propanoylamino]butanoic acid

Systemtic Name: 2-[3-(3-tert-butyl-5-methyl-7-oxidanylidene-furo[3,2-g]chromen-6-yl)propanoylamino]butanoic acid Openeye Name: 2-[3-(3-tert-butyl-5-methyl-7-oxo-furo[3,2-g]chromen-6-yl)propanoylamino]butanoic acid CAS Name: 2-[[3-(3-tert-butyl-5-methyl-7-oxo-6-furo[3,2-g][1]benzopyranyl)-1-oxopropyl]amino]butanoic acid IUPAC Name: 2-[3-(3-tert-butyl-5-methyl-7-oxofuro[3,2-g]chromen-6-yl)propanoylamino]butanoic acid Traditional Name: 2-[3-(3-tert-butyl-7-keto-5-methyl-furo[3,2-g]chromen-6-yl)propanoylamino]butyric acid Formula: C23H27NO6 MolecularWeight: 413.46358

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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)C(C)(C)C)OC1=O)C

Isomeric SMILES

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

InChI

InChI=1S/C23H27NO6/c1-6-17(21(26)27)24-20(25)8-7-13-12(2)14-9-15-16(23(3,4)5)11-29-18(15)10-19(14)30-22(13)28/h9-11,17H,6-8H2,1-5H3,(H,24,25)(H,26,27)