5-azanyl-2-[[4,5-bis(chloranyl)-1-methyl-pyrrol-2-yl]carbonylamino]-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-azanyl-2-[[4,5-bis(chloranyl)-1-methyl-pyrrol-2-yl]carbonylamino]-5-oxidanylidene-pentanoic acid Openeye Name: 5-amino-2-[(4,5-dichloro-1-methyl-pyrrole-2-carbonyl)amino]-5-oxo-pentanoic acid CAS Name: 5-amino-2-[[(4,5-dichloro-1-methyl-2-pyrrolyl)-oxomethyl]amino]-5-oxopentanoic acid IUPAC Name: 5-amino-2-[(4,5-dichloro-1-methylpyrrole-2-carbonyl)amino]-5-oxopentanoic acid Traditional Name: 5-amino-2-[(4,5-dichloro-1-methyl-pyrrole-2-carbonyl)amino]-5-keto-valeric acid Formula: C11H13Cl2N3O4 MolecularWeight: 322.14462

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC(=C1Cl)Cl)C(=O)NC(CCC(=O)N)C(=O)O

Isomeric SMILES

CN1C(=CC(=C1Cl)Cl)C(=O)NC(CCC(=O)N)C(=O)O

InChI

InChI=1S/C11H13Cl2N3O4/c1-16-7(4-5(12)9(16)13)10(18)15-6(11(19)20)2-3-8(14)17/h4,6H,2-3H2,1H3,(H2,14,17)(H,15,18)(H,19,20)