(1R,2S)-2-[2-(3-ethoxy-4-methoxy-phenyl)ethylcarbamoyl]cyclohexane-1-carboxylic acid

Systemtic Name: (1R,2S)-2-[2-(3-ethoxy-4-methoxy-phenyl)ethylcarbamoyl]cyclohexane-1-carboxylic acid Openeye Name: (1R,2S)-2-[2-(3-ethoxy-4-methoxy-phenyl)ethylcarbamoyl]cyclohexanecarboxylic acid CAS Name: (1R,2S)-2-[[2-(3-ethoxy-4-methoxyphenyl)ethylamino]-oxomethyl]-1-cyclohexanecarboxylic acid IUPAC Name: (1R,2S)-2-[2-(3-ethoxy-4-methoxyphenyl)ethylcarbamoyl]cyclohexane-1-carboxylic acid Traditional Name: (1R,2S)-2-[2-(3-ethoxy-4-methoxy-phenyl)ethylcarbamoyl]cyclohexanecarboxylic acid Formula: C19H27NO5 MolecularWeight: 349.42138

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)CCNC(=O)C2CCCCC2C(=O)O)OC

Isomeric SMILES

CCOC1=C(C=CC(=C1)CCNC(=O)[C@H]2CCCC[C@H]2C(=O)O)OC

InChI

InChI=1S/C19H27NO5/c1-3-25-17-12-13(8-9-16(17)24-2)10-11-20-18(21)14-6-4-5-7-15(14)19(22)23/h8-9,12,14-15H,3-7,10-11H2,1-2H3,(H,20,21)(H,22,23)/t14-,15+/m0/s1