4,7-bis(oxidanylidene)-1-(2-oxidanylidenepropyl)-3,3a,5,6-tetrahydro-2H-indole-7a-carboxylic acid

Systemtic Name: 4,7-bis(oxidanylidene)-1-(2-oxidanylidenepropyl)-3,3a,5,6-tetrahydro-2H-indole-7a-carboxylic acid Openeye Name: 1-acetonyl-4,7-dioxo-3,3a,5,6-tetrahydro-2H-indole-7a-carboxylic acid CAS Name: 4,7-dioxo-1-(2-oxopropyl)-3,3a,5,6-tetrahydro-2H-indole-7a-carboxylic acid IUPAC Name: 4,7-dioxo-1-(2-oxopropyl)-3,3a,5,6-tetrahydro-2H-indole-7a-carboxylic acid Traditional Name: 1-acetonyl-4,7-diketo-3,3a,5,6-tetrahydro-2H-indole-7a-carboxylic acid Formula: C12H15NO5 MolecularWeight: 253.2512

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CN1CCC2C1(C(=O)CCC2=O)C(=O)O

Isomeric SMILES

CC(=O)CN1CCC2C1(C(=O)CCC2=O)C(=O)O

InChI

InChI=1S/C12H15NO5/c1-7(14)6-13-5-4-8-9(15)2-3-10(16)12(8,13)11(17)18/h8H,2-6H2,1H3,(H,17,18)