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

Systemtic Name: 3-[2-(3-tert-butyl-5-methyl-7-oxidanylidene-furo[3,2-g]chromen-6-yl)ethanoylamino]propanoate Openeye Name: 3-[[2-(3-tert-butyl-5-methyl-7-oxo-furo[3,2-g]chromen-6-yl)acetyl]amino]propanoate CAS Name: 3-[[2-(3-tert-butyl-5-methyl-7-oxo-6-furo[3,2-g][1]benzopyranyl)-1-oxoethyl]amino]propanoate IUPAC Name: 3-[[2-(3-tert-butyl-5-methyl-7-oxofuro[3,2-g]chromen-6-yl)acetyl]amino]propanoate Traditional Name: 3-[[2-(3-tert-butyl-7-keto-5-methyl-furo[3,2-g]chromen-6-yl)acetyl]amino]propionate Formula: C21H22NO6- MolecularWeight: 384.40248

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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)NCCC(=O)[O-]

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=C3C(=C2)OC=C3C(C)(C)C)CC(=O)NCCC(=O)[O-]

InChI

InChI=1S/C21H23NO6/c1-11-12-7-14-15(21(2,3)4)10-27-16(14)9-17(12)28-20(26)13(11)8-18(23)22-6-5-19(24)25/h7,9-10H,5-6,8H2,1-4H3,(H,22,23)(H,24,25)/p-1