1-[[4,5-bis(chloranyl)-1-methyl-pyrrol-2-yl]carbonylamino]cycloheptane-1-carboxylic acid

Systemtic Name: 1-[[4,5-bis(chloranyl)-1-methyl-pyrrol-2-yl]carbonylamino]cycloheptane-1-carboxylic acid Openeye Name: 1-[(4,5-dichloro-1-methyl-pyrrole-2-carbonyl)amino]cycloheptanecarboxylic acid CAS Name: 1-[[(4,5-dichloro-1-methyl-2-pyrrolyl)-oxomethyl]amino]-1-cycloheptanecarboxylic acid IUPAC Name: 1-[(4,5-dichloro-1-methylpyrrole-2-carbonyl)amino]cycloheptane-1-carboxylic acid Traditional Name: 1-[(4,5-dichloro-1-methyl-pyrrole-2-carbonyl)amino]cycloheptanecarboxylic acid Formula: C14H18Cl2N2O3 MolecularWeight: 333.21032

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC(=C1Cl)Cl)C(=O)NC2(CCCCCC2)C(=O)O

Isomeric SMILES

CN1C(=CC(=C1Cl)Cl)C(=O)NC2(CCCCCC2)C(=O)O

InChI

InChI=1S/C14H18Cl2N2O3/c1-18-10(8-9(15)11(18)16)12(19)17-14(13(20)21)6-4-2-3-5-7-14/h8H,2-7H2,1H3,(H,17,19)(H,20,21)