(1S,2R)-2-[(5-chloranyl-2-methyl-phenyl)carbamoyl]cyclohexane-1-carboxylic acid

Systemtic Name: (1S,2R)-2-[(5-chloranyl-2-methyl-phenyl)carbamoyl]cyclohexane-1-carboxylic acid Openeye Name: (1S,2R)-2-[(5-chloro-2-methyl-phenyl)carbamoyl]cyclohexanecarboxylic acid CAS Name: (1S,2R)-2-[(5-chloro-2-methylanilino)-oxomethyl]-1-cyclohexanecarboxylic acid IUPAC Name: (1S,2R)-2-[(5-chloro-2-methylphenyl)carbamoyl]cyclohexane-1-carboxylic acid Traditional Name: (1S,2R)-2-[(5-chloro-2-methyl-phenyl)carbamoyl]cyclohexanecarboxylic acid Formula: C15H18ClNO3 MolecularWeight: 295.76132

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)NC(=O)C2CCCCC2C(=O)O

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)NC(=O)[C@@H]2CCCC[C@@H]2C(=O)O

InChI

InChI=1S/C15H18ClNO3/c1-9-6-7-10(16)8-13(9)17-14(18)11-4-2-3-5-12(11)15(19)20/h6-8,11-12H,2-5H2,1H3,(H,17,18)(H,19,20)/t11-,12+/m1/s1