3-[3-chloranylpropyl-(1-methylpyrrol-3-yl)carbonyl-amino]propanoic acid

Systemtic Name: 3-[3-chloranylpropyl-(1-methylpyrrol-3-yl)carbonyl-amino]propanoic acid Openeye Name: 3-[3-chloropropyl-(1-methylpyrrole-3-carbonyl)amino]propanoic acid CAS Name: 3-[3-chloropropyl-[(1-methyl-3-pyrrolyl)-oxomethyl]amino]propanoic acid IUPAC Name: 3-[3-chloropropyl-(1-methylpyrrole-3-carbonyl)amino]propanoic acid Traditional Name: 3-[3-chloropropyl-(1-methylpyrrole-3-carbonyl)amino]propionic acid Formula: C12H17ClN2O3 MolecularWeight: 272.72798

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC(=C1)C(=O)N(CCCCl)CCC(=O)O

Isomeric SMILES

CN1C=CC(=C1)C(=O)N(CCCCl)CCC(=O)O

InChI

InChI=1S/C12H17ClN2O3/c1-14-7-3-10(9-14)12(18)15(6-2-5-13)8-4-11(16)17/h3,7,9H,2,4-6,8H2,1H3,(H,16,17)