2-[2-cyanoethyl(methyl)carbamoyl]bicyclo[2.2.1]hept-5-ene-3-carboxylic acid

Systemtic Name: 2-[2-cyanoethyl(methyl)carbamoyl]bicyclo[2.2.1]hept-5-ene-3-carboxylic acid Openeye Name: 2-[2-cyanoethyl(methyl)carbamoyl]bicyclo[2.2.1]hept-5-ene-3-carboxylic acid CAS Name: 2-[[2-cyanoethyl(methyl)amino]-oxomethyl]-3-bicyclo[2.2.1]hept-5-enecarboxylic acid IUPAC Name: 2-[2-cyanoethyl(methyl)carbamoyl]bicyclo[2.2.1]hept-5-ene-3-carboxylic acid Traditional Name: 2-[2-cyanoethyl(methyl)carbamoyl]bicyclo[2.2.1]hept-5-ene-3-carboxylic acid Formula: C13H16N2O3 MolecularWeight: 248.27774

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC#N)C(=O)C1C2CC(C1C(=O)O)C=C2

Isomeric SMILES

CN(CCC#N)C(=O)C1C2CC(C1C(=O)O)C=C2

InChI

InChI=1S/C13H16N2O3/c1-15(6-2-5-14)12(16)10-8-3-4-9(7-8)11(10)13(17)18/h3-4,8-11H,2,6-7H2,1H3,(H,17,18)