(4,7,7-trimethyl-3-bicyclo[2.2.1]heptanyl) 2-oxidanylideneethanoate hydrate

Systemtic Name: (4,7,7-trimethyl-3-bicyclo[2.2.1]heptanyl) 2-oxidanylideneethanoate hydrate Openeye Name: (1,7,7-trimethylnorbornan-2-yl) 2-oxoacetate hydrate CAS Name: 2-oxoacetic acid (4,7,7-trimethyl-3-bicyclo[2.2.1]heptanyl) ester hydrate IUPAC Name: (4,7,7-trimethyl-3-bicyclo[2.2.1]heptanyl) 2-oxoacetate hydrate Traditional Name: 2-ketoacetic acid 2-bornyl ester hydrate Formula: C12H20O4 MolecularWeight: 228.2848

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2CCC1(C(C2)OC(=O)C=O)C)C.O

Isomeric SMILES

CC1(C2CCC1(C(C2)OC(=O)C=O)C)C.O

InChI

InChI=1S/C12H18O3.H2O/c1-11(2)8-4-5-12(11,3)9(6-8)15-10(14)7-13;/h7-9H,4-6H2,1-3H3;1H2