2-[2-(3,5-dimethyl-7-oxidanylidene-furo[3,2-g]chromen-6-yl)ethanoylamino]-3-methyl-pentanoic acid

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)O)NC(=O)CC1=C(C2=C(C=C3C(=C2)C(=CO3)C)OC1=O)C

Isomeric SMILES

CCC(C)C(C(=O)O)NC(=O)CC1=C(C2=C(C=C3C(=C2)C(=CO3)C)OC1=O)C

InChI

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