1-(2-cyanoethyl)-3,4-dimethyl-phosphole-2,5-dicarboxylic acid

Systemtic Name: 1-(2-cyanoethyl)-3,4-dimethyl-phosphole-2,5-dicarboxylic acid Openeye Name: 1-(2-cyanoethyl)-3,4-dimethyl-phosphole-2,5-dicarboxylic acid CAS Name: 1-(2-cyanoethyl)-3,4-dimethylphosphole-2,5-dicarboxylic acid IUPAC Name: 1-(2-cyanoethyl)-3,4-dimethylphosphole-2,5-dicarboxylic acid Traditional Name: 1-(2-cyanoethyl)-3,4-dimethyl-phosphole-2,5-dicarboxylic acid Formula: C11H12NO4P MolecularWeight: 253.191041

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(P(C(=C1C)C(=O)O)CCC#N)C(=O)O

Isomeric SMILES

CC1=C(P(C(=C1C)C(=O)O)CCC#N)C(=O)O

InChI

InChI=1S/C11H12NO4P/c1-6-7(2)9(11(15)16)17(5-3-4-12)8(6)10(13)14/h3,5H2,1-2H3,(H,13,14)(H,15,16)