2-[[1-(phenylmethyl)pyrrol-2-yl]carbonylamino]butanoic acid

Systemtic Name: 2-[[1-(phenylmethyl)pyrrol-2-yl]carbonylamino]butanoic acid Openeye Name: 2-[(1-benzylpyrrole-2-carbonyl)amino]butanoic acid CAS Name: 2-[[oxo-[1-(phenylmethyl)-2-pyrrolyl]methyl]amino]butanoic acid IUPAC Name: 2-[(1-benzylpyrrole-2-carbonyl)amino]butanoic acid Traditional Name: 2-[(1-benzylpyrrole-2-carbonyl)amino]butyric acid Formula: C16H18N2O3 MolecularWeight: 286.32572

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)O)NC(=O)C1=CC=CN1CC2=CC=CC=C2

Isomeric SMILES

CCC(C(=O)O)NC(=O)C1=CC=CN1CC2=CC=CC=C2

InChI

InChI=1S/C16H18N2O3/c1-2-13(16(20)21)17-15(19)14-9-6-10-18(14)11-12-7-4-3-5-8-12/h3-10,13H,2,11H2,1H3,(H,17,19)(H,20,21)