2-[1,3-bis(oxidanylidene)-3a,4,7,7a-tetrahydroisoindol-2-yl]-2-methyl-pentanoic acid

Systemtic Name: 2-[1,3-bis(oxidanylidene)-3a,4,7,7a-tetrahydroisoindol-2-yl]-2-methyl-pentanoic acid Openeye Name: 2-(1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl)-2-methyl-pentanoic acid CAS Name: 2-(1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl)-2-methylpentanoic acid IUPAC Name: 2-(1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl)-2-methylpentanoic acid Traditional Name: 2-(1,3-diketo-3a,4,7,7a-tetrahydroisoindol-2-yl)-2-methyl-valeric acid Formula: C14H19NO4 MolecularWeight: 265.30496

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)(C(=O)O)N1C(=O)C2CC=CCC2C1=O

Isomeric SMILES

CCCC(C)(C(=O)O)N1C(=O)C2CC=CCC2C1=O

InChI

InChI=1S/C14H19NO4/c1-3-8-14(2,13(18)19)15-11(16)9-6-4-5-7-10(9)12(15)17/h4-5,9-10H,3,6-8H2,1-2H3,(H,18,19)