2-[2-(7,8-dimethoxy-4-methyl-2-oxidanylidene-chromen-3-yl)ethanoylamino]-3-methyl-pentanoic acid

Systemtic Name: 2-[2-(7,8-dimethoxy-4-methyl-2-oxidanylidene-chromen-3-yl)ethanoylamino]-3-methyl-pentanoic acid Openeye Name: 2-[[2-(7,8-dimethoxy-4-methyl-2-oxo-chromen-3-yl)acetyl]amino]-3-methyl-pentanoic acid CAS Name: 2-[[2-(7,8-dimethoxy-4-methyl-2-oxo-1-benzopyran-3-yl)-1-oxoethyl]amino]-3-methylpentanoic acid IUPAC Name: 2-[[2-(7,8-dimethoxy-4-methyl-2-oxochromen-3-yl)acetyl]amino]-3-methylpentanoic acid Traditional Name: 2-[[2-(2-keto-7,8-dimethoxy-4-methyl-chromen-3-yl)acetyl]amino]-3-methyl-valeric acid Formula: C20H25NO7 MolecularWeight: 391.415

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)O)NC(=O)CC1=C(C2=C(C(=C(C=C2)OC)OC)OC1=O)C

Isomeric SMILES

CCC(C)C(C(=O)O)NC(=O)CC1=C(C2=C(C(=C(C=C2)OC)OC)OC1=O)C

InChI

InChI=1S/C20H25NO7/c1-6-10(2)16(19(23)24)21-15(22)9-13-11(3)12-7-8-14(26-4)18(27-5)17(12)28-20(13)25/h7-8,10,16H,6,9H2,1-5H3,(H,21,22)(H,23,24)