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

Systemtic Name: 2-[2-(3-tert-butyl-5-methyl-7-oxidanylidene-furo[3,2-g]chromen-6-yl)ethanoylamino]propanoic acid Openeye Name: 2-[[2-(3-tert-butyl-5-methyl-7-oxo-furo[3,2-g]chromen-6-yl)acetyl]amino]propanoic acid CAS Name: 2-[[2-(3-tert-butyl-5-methyl-7-oxo-6-furo[3,2-g][1]benzopyranyl)-1-oxoethyl]amino]propanoic acid IUPAC Name: 2-[[2-(3-tert-butyl-5-methyl-7-oxofuro[3,2-g]chromen-6-yl)acetyl]amino]propanoic acid Traditional Name: 2-[[2-(3-tert-butyl-7-keto-5-methyl-furo[3,2-g]chromen-6-yl)acetyl]amino]propionic acid Formula: C21H23NO6 MolecularWeight: 385.41042

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23NO6/c1-10-12-6-14-15(21(3,4)5)9-27-16(14)8-17(12)28-20(26)13(10)7-18(23)22-11(2)19(24)25/h6,8-9,11H,7H2,1-5H3,(H,22,23)(H,24,25)