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

Systemtic Name: 4-[(4-ethanoyl-1-methyl-pyrrol-2-yl)carbonyl-methyl-amino]butanoic acid Openeye Name: 4-[(4-acetyl-1-methyl-pyrrole-2-carbonyl)-methyl-amino]butanoic acid CAS Name: 4-[[(4-acetyl-1-methyl-2-pyrrolyl)-oxomethyl]-methylamino]butanoic acid IUPAC Name: 4-[(4-acetyl-1-methylpyrrole-2-carbonyl)-methylamino]butanoic acid Traditional Name: 4-[(4-acetyl-1-methyl-pyrrole-2-carbonyl)-methyl-amino]butyric acid Formula: C13H18N2O4 MolecularWeight: 266.29302

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CN(C(=C1)C(=O)N(C)CCCC(=O)O)C

Isomeric SMILES

CC(=O)C1=CN(C(=C1)C(=O)N(C)CCCC(=O)O)C

InChI

InChI=1S/C13H18N2O4/c1-9(16)10-7-11(15(3)8-10)13(19)14(2)6-4-5-12(17)18/h7-8H,4-6H2,1-3H3,(H,17,18)