1-cyano-3-methoxycarbonyl-2,2-dimethyl-cyclopropane-1-carboxylic acid

Systemtic Name: 1-cyano-3-methoxycarbonyl-2,2-dimethyl-cyclopropane-1-carboxylic acid Openeye Name: 1-cyano-3-methoxycarbonyl-2,2-dimethyl-cyclopropanecarboxylic acid CAS Name: 1-cyano-3-methoxycarbonyl-2,2-dimethyl-1-cyclopropanecarboxylic acid IUPAC Name: 1-cyano-3-methoxycarbonyl-2,2-dimethylcyclopropane-1-carboxylic acid Traditional Name: 3-carbomethoxy-1-cyano-2,2-dimethyl-cyclopropanecarboxylic acid Formula: C9H11NO4 MolecularWeight: 197.18794

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C1(C#N)C(=O)O)C(=O)OC)C

Isomeric SMILES

CC1(C(C1(C#N)C(=O)O)C(=O)OC)C

InChI

InChI=1S/C9H11NO4/c1-8(2)5(6(11)14-3)9(8,4-10)7(12)13/h5H,1-3H3,(H,12,13)