3-[2,5-bis(oxidanylidene)-3,4,6,6a-tetrahydro-1H-pentalen-3a-yl]propanoic acid

Systemtic Name: 3-[2,5-bis(oxidanylidene)-3,4,6,6a-tetrahydro-1H-pentalen-3a-yl]propanoic acid Openeye Name: 3-(2,5-dioxo-3,4,6,6a-tetrahydro-1H-pentalen-3a-yl)propanoic acid CAS Name: 3-(2,5-dioxo-3,4,6,6a-tetrahydro-1H-pentalen-3a-yl)propanoic acid IUPAC Name: 3-(2,5-dioxo-3,4,6,6a-tetrahydro-1H-pentalen-3a-yl)propanoic acid Traditional Name: 3-(2,5-diketo-3,4,6,6a-tetrahydro-1H-pentalen-3a-yl)propionic acid Formula: C11H14O4 MolecularWeight: 210.22646

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC(=O)CC2(CC1=O)CCC(=O)O

Isomeric SMILES

C1C2CC(=O)CC2(CC1=O)CCC(=O)O

InChI

InChI=1S/C11H14O4/c12-8-3-7-4-9(13)6-11(7,5-8)2-1-10(14)15/h7H,1-6H2,(H,14,15)