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

Systemtic Name: 2-[(4-chloranyl-1-ethyl-pyrrol-2-yl)carbonylamino]butanoic acid Openeye Name: 2-[(4-chloro-1-ethyl-pyrrole-2-carbonyl)amino]butanoic acid CAS Name: 2-[[(4-chloro-1-ethyl-2-pyrrolyl)-oxomethyl]amino]butanoic acid IUPAC Name: 2-[(4-chloro-1-ethylpyrrole-2-carbonyl)amino]butanoic acid Traditional Name: 2-[(4-chloro-1-ethyl-pyrrole-2-carbonyl)amino]butyric acid Formula: C11H15ClN2O3 MolecularWeight: 258.7014

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)O)NC(=O)C1=CC(=CN1CC)Cl

Isomeric SMILES

CCC(C(=O)O)NC(=O)C1=CC(=CN1CC)Cl

InChI

InChI=1S/C11H15ClN2O3/c1-3-8(11(16)17)13-10(15)9-5-7(12)6-14(9)4-2/h5-6,8H,3-4H2,1-2H3,(H,13,15)(H,16,17)