2-(cyanomethyl)-5-oxidanylidene-1-prop-2-enyl-cyclopentane-1-carboxylic acid

Systemtic Name: 2-(cyanomethyl)-5-oxidanylidene-1-prop-2-enyl-cyclopentane-1-carboxylic acid Openeye Name: 1-allyl-2-(cyanomethyl)-5-oxo-cyclopentanecarboxylic acid CAS Name: 2-(cyanomethyl)-5-oxo-1-prop-2-enyl-1-cyclopentanecarboxylic acid IUPAC Name: 2-(cyanomethyl)-5-oxo-1-prop-2-enylcyclopentane-1-carboxylic acid Traditional Name: 1-allyl-2-(cyanomethyl)-5-keto-cyclopentanecarboxylic acid Formula: C11H13NO3 MolecularWeight: 207.22582

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Descriptors Computed from Structure

Canonical SMILES:

C=CCC1(C(CCC1=O)CC#N)C(=O)O

Isomeric SMILES

C=CCC1(C(CCC1=O)CC#N)C(=O)O

InChI

InChI=1S/C11H13NO3/c1-2-6-11(10(14)15)8(5-7-12)3-4-9(11)13/h2,8H,1,3-6H2,(H,14,15)