(1R,2S)-2-[[4-(4-ethylphenoxy)phenyl]methylcarbamoyl]cyclohexane-1-carboxylic acid

Systemtic Name: (1R,2S)-2-[[4-(4-ethylphenoxy)phenyl]methylcarbamoyl]cyclohexane-1-carboxylic acid Openeye Name: (1R,2S)-2-[[4-(4-ethylphenoxy)phenyl]methylcarbamoyl]cyclohexanecarboxylic acid CAS Name: (1R,2S)-2-[[[4-(4-ethylphenoxy)phenyl]methylamino]-oxomethyl]-1-cyclohexanecarboxylic acid IUPAC Name: (1R,2S)-2-[[4-(4-ethylphenoxy)phenyl]methylcarbamoyl]cyclohexane-1-carboxylic acid Traditional Name: (1R,2S)-2-[[4-(4-ethylphenoxy)benzyl]carbamoyl]cyclohexanecarboxylic acid Formula: C23H27NO4 MolecularWeight: 381.46478

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)OC2=CC=C(C=C2)CNC(=O)C3CCCCC3C(=O)O

Isomeric SMILES

CCC1=CC=C(C=C1)OC2=CC=C(C=C2)CNC(=O)[C@H]3CCCC[C@H]3C(=O)O

InChI

InChI=1S/C23H27NO4/c1-2-16-7-11-18(12-8-16)28-19-13-9-17(10-14-19)15-24-22(25)20-5-3-4-6-21(20)23(26)27/h7-14,20-21H,2-6,15H2,1H3,(H,24,25)(H,26,27)/t20-,21+/m0/s1