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

Systemtic Name: 2-[3-(3-tert-butyl-5-methyl-7-oxidanylidene-furo[3,2-g]chromen-6-yl)propanoylamino]-2-phenyl-ethanoic acid Openeye Name: 2-[3-(3-tert-butyl-5-methyl-7-oxo-furo[3,2-g]chromen-6-yl)propanoylamino]-2-phenyl-acetic acid CAS Name: 2-[[3-(3-tert-butyl-5-methyl-7-oxo-6-furo[3,2-g][1]benzopyranyl)-1-oxopropyl]amino]-2-phenylacetic acid IUPAC Name: 2-[3-(3-tert-butyl-5-methyl-7-oxofuro[3,2-g]chromen-6-yl)propanoylamino]-2-phenylacetic acid Traditional Name: 2-[3-(3-tert-butyl-7-keto-5-methyl-furo[3,2-g]chromen-6-yl)propanoylamino]-2-phenyl-acetic acid Formula: C27H27NO6 MolecularWeight: 461.50638

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C=C3C(=C2)OC=C3C(C)(C)C)CCC(=O)NC(C4=CC=CC=C4)C(=O)O

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=C3C(=C2)OC=C3C(C)(C)C)CCC(=O)NC(C4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C27H27NO6/c1-15-17(10-11-23(29)28-24(25(30)31)16-8-6-5-7-9-16)26(32)34-22-13-21-19(12-18(15)22)20(14-33-21)27(2,3)4/h5-9,12-14,24H,10-11H2,1-4H3,(H,28,29)(H,30,31)