(1R,2S)-2-[(2-chloranyl-4,6-dimethyl-phenyl)carbamoyl]cyclohexane-1-carboxylate

Systemtic Name: (1R,2S)-2-[(2-chloranyl-4,6-dimethyl-phenyl)carbamoyl]cyclohexane-1-carboxylate Openeye Name: (1R,2S)-2-[(2-chloro-4,6-dimethyl-phenyl)carbamoyl]cyclohexanecarboxylate CAS Name: (1R,2S)-2-[(2-chloro-4,6-dimethylanilino)-oxomethyl]-1-cyclohexanecarboxylate IUPAC Name: (1R,2S)-2-[(2-chloro-4,6-dimethylphenyl)carbamoyl]cyclohexane-1-carboxylate Traditional Name: (1R,2S)-2-[(2-chloro-4,6-dimethyl-phenyl)carbamoyl]cyclohexanecarboxylate Formula: C16H19ClNO3- MolecularWeight: 308.77996

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)Cl)NC(=O)C2CCCCC2C(=O)[O-])C

Isomeric SMILES

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

InChI

InChI=1S/C16H20ClNO3/c1-9-7-10(2)14(13(17)8-9)18-15(19)11-5-3-4-6-12(11)16(20)21/h7-8,11-12H,3-6H2,1-2H3,(H,18,19)(H,20,21)/p-1/t11-,12+/m0/s1