3-[butyl(1H-pyrrol-2-ylcarbonyl)amino]propanoic acid

Systemtic Name: 3-[butyl(1H-pyrrol-2-ylcarbonyl)amino]propanoic acid Openeye Name: 3-[butyl(1H-pyrrole-2-carbonyl)amino]propanoic acid CAS Name: 3-[butyl-[oxo(1H-pyrrol-2-yl)methyl]amino]propanoic acid IUPAC Name: 3-[butyl(1H-pyrrole-2-carbonyl)amino]propanoic acid Traditional Name: 3-[butyl(1H-pyrrole-2-carbonyl)amino]propionic acid Formula: C12H18N2O3 MolecularWeight: 238.28292

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCC(=O)O)C(=O)C1=CC=CN1

Isomeric SMILES

CCCCN(CCC(=O)O)C(=O)C1=CC=CN1

InChI

InChI=1S/C12H18N2O3/c1-2-3-8-14(9-6-11(15)16)12(17)10-5-4-7-13-10/h4-5,7,13H,2-3,6,8-9H2,1H3,(H,15,16)