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

Systemtic Name: 3-methyl-2-[2-[4-methyl-7,8-bis(oxidanyl)-2-oxidanylidene-chromen-3-yl]ethanoylamino]pentanoic acid Openeye Name: 2-[[2-(7,8-dihydroxy-4-methyl-2-oxo-chromen-3-yl)acetyl]amino]-3-methyl-pentanoic acid CAS Name: 2-[[2-(7,8-dihydroxy-4-methyl-2-oxo-1-benzopyran-3-yl)-1-oxoethyl]amino]-3-methylpentanoic acid IUPAC Name: 2-[[2-(7,8-dihydroxy-4-methyl-2-oxochromen-3-yl)acetyl]amino]-3-methylpentanoic acid Traditional Name: 2-[[2-(7,8-dihydroxy-2-keto-4-methyl-chromen-3-yl)acetyl]amino]-3-methyl-valeric acid Formula: C18H21NO7 MolecularWeight: 363.36184

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H21NO7/c1-4-8(2)14(17(23)24)19-13(21)7-11-9(3)10-5-6-12(20)15(22)16(10)26-18(11)25/h5-6,8,14,20,22H,4,7H2,1-3H3,(H,19,21)(H,23,24)