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

Systemtic Name: 4-[(4-chloranyl-1-propyl-pyrrol-2-yl)carbonylamino]butanoic acid Openeye Name: 4-[(4-chloro-1-propyl-pyrrole-2-carbonyl)amino]butanoic acid CAS Name: 4-[[(4-chloro-1-propyl-2-pyrrolyl)-oxomethyl]amino]butanoic acid IUPAC Name: 4-[(4-chloro-1-propylpyrrole-2-carbonyl)amino]butanoic acid Traditional Name: 4-[(4-chloro-1-propyl-pyrrole-2-carbonyl)amino]butyric acid Formula: C12H17ClN2O3 MolecularWeight: 272.72798

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C=C(C=C1C(=O)NCCCC(=O)O)Cl

Isomeric SMILES

CCCN1C=C(C=C1C(=O)NCCCC(=O)O)Cl

InChI

InChI=1S/C12H17ClN2O3/c1-2-6-15-8-9(13)7-10(15)12(18)14-5-3-4-11(16)17/h7-8H,2-6H2,1H3,(H,14,18)(H,16,17)