2-[(4-ethanoyl-1H-pyrrol-2-yl)carbonylamino]-3,3-dimethyl-butanoic acid

Systemtic Name: 2-[(4-ethanoyl-1H-pyrrol-2-yl)carbonylamino]-3,3-dimethyl-butanoic acid Openeye Name: 2-[(4-acetyl-1H-pyrrole-2-carbonyl)amino]-3,3-dimethyl-butanoic acid CAS Name: 2-[[(4-acetyl-1H-pyrrol-2-yl)-oxomethyl]amino]-3,3-dimethylbutanoic acid IUPAC Name: 2-[(4-acetyl-1H-pyrrole-2-carbonyl)amino]-3,3-dimethylbutanoic acid Traditional Name: 2-[(4-acetyl-1H-pyrrole-2-carbonyl)amino]-3,3-dimethyl-butyric acid Formula: C13H18N2O4 MolecularWeight: 266.29302

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CNC(=C1)C(=O)NC(C(=O)O)C(C)(C)C

Isomeric SMILES

CC(=O)C1=CNC(=C1)C(=O)NC(C(=O)O)C(C)(C)C

InChI

InChI=1S/C13H18N2O4/c1-7(16)8-5-9(14-6-8)11(17)15-10(12(18)19)13(2,3)4/h5-6,10,14H,1-4H3,(H,15,17)(H,18,19)