5-methyl-1,3-bis(oxidanylidene)-2-propan-2-yl-3a,4,5,7a-tetrahydroisoindole-4-carboxylic acid

Systemtic Name: 5-methyl-1,3-bis(oxidanylidene)-2-propan-2-yl-3a,4,5,7a-tetrahydroisoindole-4-carboxylic acid Openeye Name: 2-isopropyl-5-methyl-1,3-dioxo-3a,4,5,7a-tetrahydroisoindole-4-carboxylic acid CAS Name: 5-methyl-1,3-dioxo-2-propan-2-yl-3a,4,5,7a-tetrahydroisoindole-4-carboxylic acid IUPAC Name: 5-methyl-1,3-dioxo-2-propan-2-yl-3a,4,5,7a-tetrahydroisoindole-4-carboxylic acid Traditional Name: 2-isopropyl-1,3-diketo-5-methyl-3a,4,5,7a-tetrahydroisoindole-4-carboxylic acid Formula: C13H17NO4 MolecularWeight: 251.27838

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Descriptors Computed from Structure

Canonical SMILES:

CC1C=CC2C(C1C(=O)O)C(=O)N(C2=O)C(C)C

Isomeric SMILES

CC1C=CC2C(C1C(=O)O)C(=O)N(C2=O)C(C)C

InChI

InChI=1S/C13H17NO4/c1-6(2)14-11(15)8-5-4-7(3)9(13(17)18)10(8)12(14)16/h4-10H,1-3H3,(H,17,18)