(1R,2S)-2-[2-(2-ethoxy-3-methoxy-phenyl)ethylcarbamoyl]cyclohexane-1-carboxylate

Systemtic Name: (1R,2S)-2-[2-(2-ethoxy-3-methoxy-phenyl)ethylcarbamoyl]cyclohexane-1-carboxylate Openeye Name: (1R,2S)-2-[2-(2-ethoxy-3-methoxy-phenyl)ethylcarbamoyl]cyclohexanecarboxylate CAS Name: (1R,2S)-2-[[2-(2-ethoxy-3-methoxyphenyl)ethylamino]-oxomethyl]-1-cyclohexanecarboxylate IUPAC Name: (1R,2S)-2-[2-(2-ethoxy-3-methoxyphenyl)ethylcarbamoyl]cyclohexane-1-carboxylate Traditional Name: (1R,2S)-2-[2-(2-ethoxy-3-methoxy-phenyl)ethylcarbamoyl]cyclohexanecarboxylate Formula: C19H26NO5- MolecularWeight: 348.41344

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC=C1OC)CCNC(=O)C2CCCCC2C(=O)[O-]

Isomeric SMILES

CCOC1=C(C=CC=C1OC)CCNC(=O)[C@H]2CCCC[C@H]2C(=O)[O-]

InChI

InChI=1S/C19H27NO5/c1-3-25-17-13(7-6-10-16(17)24-2)11-12-20-18(21)14-8-4-5-9-15(14)19(22)23/h6-7,10,14-15H,3-5,8-9,11-12H2,1-2H3,(H,20,21)(H,22,23)/p-1/t14-,15+/m0/s1