(2S)-2-[2-(5-ethanoyl-1-methyl-pyrrol-2-yl)ethanoylamino]propanoic acid

Systemtic Name: (2S)-2-[2-(5-ethanoyl-1-methyl-pyrrol-2-yl)ethanoylamino]propanoic acid Openeye Name: (2S)-2-[[2-(5-acetyl-1-methyl-pyrrol-2-yl)acetyl]amino]propanoic acid CAS Name: (2S)-2-[[2-(5-acetyl-1-methyl-2-pyrrolyl)-1-oxoethyl]amino]propanoic acid IUPAC Name: (2S)-2-[[2-(5-acetyl-1-methylpyrrol-2-yl)acetyl]amino]propanoic acid Traditional Name: (2S)-2-[[2-(5-acetyl-1-methyl-pyrrol-2-yl)acetyl]amino]propionic acid Formula: C12H16N2O4 MolecularWeight: 252.26644

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)NC(=O)CC1=CC=C(N1C)C(=O)C

Isomeric SMILES

C[C@@H](C(=O)O)NC(=O)CC1=CC=C(N1C)C(=O)C

InChI

InChI=1S/C12H16N2O4/c1-7(12(17)18)13-11(16)6-9-4-5-10(8(2)15)14(9)3/h4-5,7H,6H2,1-3H3,(H,13,16)(H,17,18)/t7-/m0/s1