3-methyl-3,5-bis(oxidanyl)pentanoic acid; quinoline

Systemtic Name: 3-methyl-3,5-bis(oxidanyl)pentanoic acid; quinoline Openeye Name: 3,5-dihydroxy-3-methyl-pentanoic acid; quinoline CAS Name: 3,5-dihydroxy-3-methylpentanoic acid; quinoline IUPAC Name: 3,5-dihydroxy-3-methylpentanoic acid; quinoline Traditional Name: 3,5-dihydroxy-3-methyl-valeric acid; quinoline Formula: C15H19NO4 MolecularWeight: 277.31566

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CCO)(CC(=O)O)O.C1=CC=C2C(=C1)C=CC=N2

Isomeric SMILES

CC(CCO)(CC(=O)O)O.C1=CC=C2C(=C1)C=CC=N2

InChI

InChI=1S/C9H7N.C6H12O4/c1-2-6-9-8(4-1)5-3-7-10-9;1-6(10,2-3-7)4-5(8)9/h1-7H;7,10H,2-4H2,1H3,(H,8,9)