2-[(4-chloranyl-1-methyl-pyrrol-2-yl)carbonylamino]butanoic acid

Systemtic Name: 2-[(4-chloranyl-1-methyl-pyrrol-2-yl)carbonylamino]butanoic acid Openeye Name: 2-[(4-chloro-1-methyl-pyrrole-2-carbonyl)amino]butanoic acid CAS Name: 2-[[(4-chloro-1-methyl-2-pyrrolyl)-oxomethyl]amino]butanoic acid IUPAC Name: 2-[(4-chloro-1-methylpyrrole-2-carbonyl)amino]butanoic acid Traditional Name: 2-[(4-chloro-1-methyl-pyrrole-2-carbonyl)amino]butyric acid Formula: C10H13ClN2O3 MolecularWeight: 244.67482

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)O)NC(=O)C1=CC(=CN1C)Cl

Isomeric SMILES

CCC(C(=O)O)NC(=O)C1=CC(=CN1C)Cl

InChI

InChI=1S/C10H13ClN2O3/c1-3-7(10(15)16)12-9(14)8-4-6(11)5-13(8)2/h4-5,7H,3H2,1-2H3,(H,12,14)(H,15,16)