2-[(4-ethanoyl-1-methyl-pyrrol-2-yl)carbonylamino]butanoic acid

Systemtic Name: 2-[(4-ethanoyl-1-methyl-pyrrol-2-yl)carbonylamino]butanoic acid Openeye Name: 2-[(4-acetyl-1-methyl-pyrrole-2-carbonyl)amino]butanoic acid CAS Name: 2-[[(4-acetyl-1-methyl-2-pyrrolyl)-oxomethyl]amino]butanoic acid IUPAC Name: 2-[(4-acetyl-1-methylpyrrole-2-carbonyl)amino]butanoic acid Traditional Name: 2-[(4-acetyl-1-methyl-pyrrole-2-carbonyl)amino]butyric acid Formula: C12H16N2O4 MolecularWeight: 252.26644

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)O)NC(=O)C1=CC(=CN1C)C(=O)C

Isomeric SMILES

CCC(C(=O)O)NC(=O)C1=CC(=CN1C)C(=O)C

InChI

InChI=1S/C12H16N2O4/c1-4-9(12(17)18)13-11(16)10-5-8(7(2)15)6-14(10)3/h5-6,9H,4H2,1-3H3,(H,13,16)(H,17,18)