3-[5-(2-carboxyethyl)-4-(dimethylamino)-1H-pyrrol-3-yl]propanoic acid

Systemtic Name: 3-[5-(2-carboxyethyl)-4-(dimethylamino)-1H-pyrrol-3-yl]propanoic acid Openeye Name: 3-[5-(2-carboxyethyl)-4-(dimethylamino)-1H-pyrrol-3-yl]propanoic acid CAS Name: 3-[5-(2-carboxyethyl)-4-(dimethylamino)-1H-pyrrol-3-yl]propanoic acid IUPAC Name: 3-[5-(2-carboxyethyl)-4-(dimethylamino)-1H-pyrrol-3-yl]propanoic acid Traditional Name: 3-[5-(2-carboxyethyl)-4-(dimethylamino)-1H-pyrrol-3-yl]propionic acid Formula: C12H18N2O4 MolecularWeight: 254.28232

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=C(NC=C1CCC(=O)O)CCC(=O)O

Isomeric SMILES

CN(C)C1=C(NC=C1CCC(=O)O)CCC(=O)O

InChI

InChI=1S/C12H18N2O4/c1-14(2)12-8(3-5-10(15)16)7-13-9(12)4-6-11(17)18/h7,13H,3-6H2,1-2H3,(H,15,16)(H,17,18)