methyl 6-[[4,5-bis(chloranyl)-1-methyl-pyrrol-2-yl]carbonylamino]hexanoate

Systemtic Name: methyl 6-[[4,5-bis(chloranyl)-1-methyl-pyrrol-2-yl]carbonylamino]hexanoate Openeye Name: methyl 6-[(4,5-dichloro-1-methyl-pyrrole-2-carbonyl)amino]hexanoate CAS Name: 6-[[(4,5-dichloro-1-methyl-2-pyrrolyl)-oxomethyl]amino]hexanoic acid methyl ester IUPAC Name: methyl 6-[(4,5-dichloro-1-methylpyrrole-2-carbonyl)amino]hexanoate Traditional Name: 6-[(4,5-dichloro-1-methyl-pyrrole-2-carbonyl)amino]hexanoic acid methyl ester Formula: C13H18Cl2N2O3 MolecularWeight: 321.19962

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC(=C1Cl)Cl)C(=O)NCCCCCC(=O)OC

Isomeric SMILES

CN1C(=CC(=C1Cl)Cl)C(=O)NCCCCCC(=O)OC

InChI

InChI=1S/C13H18Cl2N2O3/c1-17-10(8-9(14)12(17)15)13(19)16-7-5-3-4-6-11(18)20-2/h8H,3-7H2,1-2H3,(H,16,19)