1-[(4-chloranyl-1-methyl-pyrrol-2-yl)carbonylamino]-4-methyl-cyclohexane-1-carboxylic acid

Systemtic Name: 1-[(4-chloranyl-1-methyl-pyrrol-2-yl)carbonylamino]-4-methyl-cyclohexane-1-carboxylic acid Openeye Name: 1-[(4-chloro-1-methyl-pyrrole-2-carbonyl)amino]-4-methyl-cyclohexanecarboxylic acid CAS Name: 1-[[(4-chloro-1-methyl-2-pyrrolyl)-oxomethyl]amino]-4-methyl-1-cyclohexanecarboxylic acid IUPAC Name: 1-[(4-chloro-1-methylpyrrole-2-carbonyl)amino]-4-methylcyclohexane-1-carboxylic acid Traditional Name: 1-[(4-chloro-1-methyl-pyrrole-2-carbonyl)amino]-4-methyl-cyclohexanecarboxylic acid Formula: C14H19ClN2O3 MolecularWeight: 298.76526

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)(C(=O)O)NC(=O)C2=CC(=CN2C)Cl

Isomeric SMILES

CC1CCC(CC1)(C(=O)O)NC(=O)C2=CC(=CN2C)Cl

InChI

InChI=1S/C14H19ClN2O3/c1-9-3-5-14(6-4-9,13(19)20)16-12(18)11-7-10(15)8-17(11)2/h7-9H,3-6H2,1-2H3,(H,16,18)(H,19,20)