(1R,2R)-2-[(4-bromanyl-2-methyl-phenyl)carbamoyl]cyclohexane-1-carboxylic acid

Systemtic Name: (1R,2R)-2-[(4-bromanyl-2-methyl-phenyl)carbamoyl]cyclohexane-1-carboxylic acid Openeye Name: (1R,2R)-2-[(4-bromo-2-methyl-phenyl)carbamoyl]cyclohexanecarboxylic acid CAS Name: (1R,2R)-2-[(4-bromo-2-methylanilino)-oxomethyl]-1-cyclohexanecarboxylic acid IUPAC Name: (1R,2R)-2-[(4-bromo-2-methylphenyl)carbamoyl]cyclohexane-1-carboxylic acid Traditional Name: (1R,2R)-2-[(4-bromo-2-methyl-phenyl)carbamoyl]cyclohexanecarboxylic acid Formula: C15H18BrNO3 MolecularWeight: 340.21232

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(=O)C2CCCCC2C(=O)O

Isomeric SMILES

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

InChI

InChI=1S/C15H18BrNO3/c1-9-8-10(16)6-7-13(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