2-ethynyl-1-methoxycarbonyl-4-methylidene-piperidine-2,6-dicarboxylic acid

Systemtic Name: 2-ethynyl-1-methoxycarbonyl-4-methylidene-piperidine-2,6-dicarboxylic acid Openeye Name: 2-ethynyl-1-methoxycarbonyl-4-methylene-piperidine-2,6-dicarboxylic acid CAS Name: 2-ethynyl-1-methoxycarbonyl-4-methylenepiperidine-2,6-dicarboxylic acid IUPAC Name: 2-ethynyl-1-methoxycarbonyl-4-methylidenepiperidine-2,6-dicarboxylic acid Traditional Name: 1-carbomethoxy-2-ethynyl-4-methylene-piperidine-2,6-dicarboxylic acid Formula: C12H13NO6 MolecularWeight: 267.23472

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)N1C(CC(=C)CC1(C#C)C(=O)O)C(=O)O

Isomeric SMILES

COC(=O)N1C(CC(=C)CC1(C#C)C(=O)O)C(=O)O

InChI

InChI=1S/C12H13NO6/c1-4-12(10(16)17)6-7(2)5-8(9(14)15)13(12)11(18)19-3/h1,8H,2,5-6H2,3H3,(H,14,15)(H,16,17)