3-[4-(carboxymethyl)-5-cyano-2-methyl-1H-pyrrol-3-yl]propanoic acid

Systemtic Name: 3-[4-(carboxymethyl)-5-cyano-2-methyl-1H-pyrrol-3-yl]propanoic acid Openeye Name: 3-[4-(carboxymethyl)-5-cyano-2-methyl-1H-pyrrol-3-yl]propanoic acid CAS Name: 3-[4-(carboxymethyl)-5-cyano-2-methyl-1H-pyrrol-3-yl]propanoic acid IUPAC Name: 3-[4-(carboxymethyl)-5-cyano-2-methyl-1H-pyrrol-3-yl]propanoic acid Traditional Name: 3-[4-(carboxymethyl)-5-cyano-2-methyl-1H-pyrrol-3-yl]propionic acid Formula: C11H12N2O4 MolecularWeight: 236.22398

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(N1)C#N)CC(=O)O)CCC(=O)O

Isomeric SMILES

CC1=C(C(=C(N1)C#N)CC(=O)O)CCC(=O)O

InChI

InChI=1S/C11H12N2O4/c1-6-7(2-3-10(14)15)8(4-11(16)17)9(5-12)13-6/h13H,2-4H2,1H3,(H,14,15)(H,16,17)