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

Systemtic Name: 4-[(4-chloranyl-1H-pyrrol-2-yl)carbonylamino]butanoic acid Openeye Name: 4-[(4-chloro-1H-pyrrole-2-carbonyl)amino]butanoic acid CAS Name: 4-[[(4-chloro-1H-pyrrol-2-yl)-oxomethyl]amino]butanoic acid IUPAC Name: 4-[(4-chloro-1H-pyrrole-2-carbonyl)amino]butanoic acid Traditional Name: 4-[(4-chloro-1H-pyrrole-2-carbonyl)amino]butyric acid Formula: C9H11ClN2O3 MolecularWeight: 230.64824

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(NC=C1Cl)C(=O)NCCCC(=O)O

Isomeric SMILES

C1=C(NC=C1Cl)C(=O)NCCCC(=O)O

InChI

InChI=1S/C9H11ClN2O3/c10-6-4-7(12-5-6)9(15)11-3-1-2-8(13)14/h4-5,12H,1-3H2,(H,11,15)(H,13,14)