(1S,2S)-2-[(3-chlorophenyl)methylcarbamoyl]cyclohexane-1-carboxylic acid

Systemtic Name: (1S,2S)-2-[(3-chlorophenyl)methylcarbamoyl]cyclohexane-1-carboxylic acid Openeye Name: (1S,2S)-2-[(3-chlorophenyl)methylcarbamoyl]cyclohexanecarboxylic acid CAS Name: (1S,2S)-2-[[(3-chlorophenyl)methylamino]-oxomethyl]-1-cyclohexanecarboxylic acid IUPAC Name: (1S,2S)-2-[(3-chlorophenyl)methylcarbamoyl]cyclohexane-1-carboxylic acid Traditional Name: (1S,2S)-2-[(3-chlorobenzyl)carbamoyl]cyclohexanecarboxylic acid Formula: C15H18ClNO3 MolecularWeight: 295.76132

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)C(=O)NCC2=CC(=CC=C2)Cl)C(=O)O

Isomeric SMILES

C1CC[C@@H]([C@H](C1)C(=O)NCC2=CC(=CC=C2)Cl)C(=O)O

InChI

InChI=1S/C15H18ClNO3/c16-11-5-3-4-10(8-11)9-17-14(18)12-6-1-2-7-13(12)15(19)20/h3-5,8,12-13H,1-2,6-7,9H2,(H,17,18)(H,19,20)/t12-,13-/m0/s1