(1S,2S)-2-[(5-chloranyl-2,4-dimethoxy-phenyl)carbamoyl]cyclohexane-1-carboxylate

Systemtic Name: (1S,2S)-2-[(5-chloranyl-2,4-dimethoxy-phenyl)carbamoyl]cyclohexane-1-carboxylate Openeye Name: (1S,2S)-2-[(5-chloro-2,4-dimethoxy-phenyl)carbamoyl]cyclohexanecarboxylate CAS Name: (1S,2S)-2-[(5-chloro-2,4-dimethoxyanilino)-oxomethyl]-1-cyclohexanecarboxylate IUPAC Name: (1S,2S)-2-[(5-chloro-2,4-dimethoxyphenyl)carbamoyl]cyclohexane-1-carboxylate Traditional Name: (1S,2S)-2-[(5-chloro-2,4-dimethoxy-phenyl)carbamoyl]cyclohexanecarboxylate Formula: C16H19ClNO5- MolecularWeight: 340.77876

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1NC(=O)C2CCCCC2C(=O)[O-])Cl)OC

Isomeric SMILES

COC1=CC(=C(C=C1NC(=O)[C@H]2CCCC[C@@H]2C(=O)[O-])Cl)OC

InChI

InChI=1S/C16H20ClNO5/c1-22-13-8-14(23-2)12(7-11(13)17)18-15(19)9-5-3-4-6-10(9)16(20)21/h7-10H,3-6H2,1-2H3,(H,18,19)(H,20,21)/p-1/t9-,10-/m0/s1