2-[(1-ethylpyrrol-2-yl)carbonylamino]-3-methyl-butanoic acid

Systemtic Name: 2-[(1-ethylpyrrol-2-yl)carbonylamino]-3-methyl-butanoic acid Openeye Name: 2-[(1-ethylpyrrole-2-carbonyl)amino]-3-methyl-butanoic acid CAS Name: 2-[[(1-ethyl-2-pyrrolyl)-oxomethyl]amino]-3-methylbutanoic acid IUPAC Name: 2-[(1-ethylpyrrole-2-carbonyl)amino]-3-methylbutanoic acid Traditional Name: 2-[(1-ethylpyrrole-2-carbonyl)amino]-3-methyl-butyric acid Formula: C12H18N2O3 MolecularWeight: 238.28292

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=CC=C1C(=O)NC(C(C)C)C(=O)O

Isomeric SMILES

CCN1C=CC=C1C(=O)NC(C(C)C)C(=O)O

InChI

InChI=1S/C12H18N2O3/c1-4-14-7-5-6-9(14)11(15)13-10(8(2)3)12(16)17/h5-8,10H,4H2,1-3H3,(H,13,15)(H,16,17)