2-[2-(3-tert-butyl-5,9-dimethyl-7-oxidanylidene-furo[3,2-g]chromen-6-yl)ethanoylamino]-2-phenyl-ethanoic acid

Systemtic Name: 2-[2-(3-tert-butyl-5,9-dimethyl-7-oxidanylidene-furo[3,2-g]chromen-6-yl)ethanoylamino]-2-phenyl-ethanoic acid Openeye Name: 2-[[2-(3-tert-butyl-5,9-dimethyl-7-oxo-furo[3,2-g]chromen-6-yl)acetyl]amino]-2-phenyl-acetic acid CAS Name: 2-[[2-(3-tert-butyl-5,9-dimethyl-7-oxo-6-furo[3,2-g][1]benzopyranyl)-1-oxoethyl]amino]-2-phenylacetic acid IUPAC Name: 2-[[2-(3-tert-butyl-5,9-dimethyl-7-oxofuro[3,2-g]chromen-6-yl)acetyl]amino]-2-phenylacetic acid Traditional Name: 2-[[2-(3-tert-butyl-7-keto-5,9-dimethyl-furo[3,2-g]chromen-6-yl)acetyl]amino]-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(=COC3=C2C)C(C)(C)C)CC(=O)NC(C4=CC=CC=C4)C(=O)O

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=C3C(=COC3=C2C)C(C)(C)C)CC(=O)NC(C4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C27H27NO6/c1-14-17-11-19-20(27(3,4)5)13-33-23(19)15(2)24(17)34-26(32)18(14)12-21(29)28-22(25(30)31)16-9-7-6-8-10-16/h6-11,13,22H,12H2,1-5H3,(H,28,29)(H,30,31)