4-(cyanomethyl)-5-methoxycarbonyl-cyclopentane-1,3-dicarboxylic acid

Systemtic Name: 4-(cyanomethyl)-5-methoxycarbonyl-cyclopentane-1,3-dicarboxylic acid Openeye Name: 4-(cyanomethyl)-5-methoxycarbonyl-cyclopentane-1,3-dicarboxylic acid CAS Name: 4-(cyanomethyl)-5-methoxycarbonylcyclopentane-1,3-dicarboxylic acid IUPAC Name: 4-(cyanomethyl)-5-methoxycarbonylcyclopentane-1,3-dicarboxylic acid Traditional Name: 4-carbomethoxy-5-(cyanomethyl)cyclopentane-1,3-dicarboxylic acid Formula: C11H13NO6 MolecularWeight: 255.22402

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1C(CC(C1CC#N)C(=O)O)C(=O)O

Isomeric SMILES

COC(=O)C1C(CC(C1CC#N)C(=O)O)C(=O)O

InChI

InChI=1S/C11H13NO6/c1-18-11(17)8-5(2-3-12)6(9(13)14)4-7(8)10(15)16/h5-8H,2,4H2,1H3,(H,13,14)(H,15,16)