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

Systemtic Name: 4-[1,3-bis(oxidanylidene)-3a,4,7,7a-tetrahydroisoindol-2-yl]cyclohexane-1-carboxylic acid Openeye Name: 4-(1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl)cyclohexanecarboxylic acid CAS Name: 4-(1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl)-1-cyclohexanecarboxylic acid IUPAC Name: 4-(1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl)cyclohexane-1-carboxylic acid Traditional Name: 4-(1,3-diketo-3a,4,7,7a-tetrahydroisoindol-2-yl)cyclohexanecarboxylic acid Formula: C15H19NO4 MolecularWeight: 277.31566

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1C(=O)O)N2C(=O)C3CC=CCC3C2=O

Isomeric SMILES

C1CC(CCC1C(=O)O)N2C(=O)C3CC=CCC3C2=O

InChI

InChI=1S/C15H19NO4/c17-13-11-3-1-2-4-12(11)14(18)16(13)10-7-5-9(6-8-10)15(19)20/h1-2,9-12H,3-8H2,(H,19,20)