2-[8-chloranyl-4a,8-dimethyl-8a-oxidanyl-1,7-bis(oxidanylidene)-3,4-dihydro-2H-naphthalen-2-yl]propanoic acid

Systemtic Name: 2-[8-chloranyl-4a,8-dimethyl-8a-oxidanyl-1,7-bis(oxidanylidene)-3,4-dihydro-2H-naphthalen-2-yl]propanoic acid Openeye Name: 2-(8-chloro-8a-hydroxy-4a,8-dimethyl-1,7-dioxo-3,4-dihydro-2H-naphthalen-2-yl)propanoic acid CAS Name: 2-(8-chloro-8a-hydroxy-4a,8-dimethyl-1,7-dioxo-3,4-dihydro-2H-naphthalen-2-yl)propanoic acid IUPAC Name: 2-(8-chloro-8a-hydroxy-4a,8-dimethyl-1,7-dioxo-3,4-dihydro-2H-naphthalen-2-yl)propanoic acid Traditional Name: 2-(8-chloro-8a-hydroxy-1,7-diketo-4a,8-dimethyl-3,4-dihydro-2H-naphthalen-2-yl)propionic acid Formula: C15H19ClO5 MolecularWeight: 314.76136

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1CCC2(C=CC(=O)C(C2(C1=O)O)(C)Cl)C)C(=O)O

Isomeric SMILES

CC(C1CCC2(C=CC(=O)C(C2(C1=O)O)(C)Cl)C)C(=O)O

InChI

InChI=1S/C15H19ClO5/c1-8(12(19)20)9-4-6-13(2)7-5-10(17)14(3,16)15(13,21)11(9)18/h5,7-9,21H,4,6H2,1-3H3,(H,19,20)