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

Systemtic Name: (1R,2S)-2-[2-(3-methoxy-2-pentoxy-phenyl)ethylcarbamoyl]cyclohexane-1-carboxylic acid Openeye Name: (1R,2S)-2-[2-(3-methoxy-2-pentoxy-phenyl)ethylcarbamoyl]cyclohexanecarboxylic acid CAS Name: (1R,2S)-2-[[2-(3-methoxy-2-pentoxyphenyl)ethylamino]-oxomethyl]-1-cyclohexanecarboxylic acid IUPAC Name: (1R,2S)-2-[2-(3-methoxy-2-pentoxyphenyl)ethylcarbamoyl]cyclohexane-1-carboxylic acid Traditional Name: (1R,2S)-2-[2-(2-amoxy-3-methoxy-phenyl)ethylcarbamoyl]cyclohexanecarboxylic acid Formula: C22H33NO5 MolecularWeight: 391.50112

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=C(C=CC=C1OC)CCNC(=O)C2CCCCC2C(=O)O

Isomeric SMILES

CCCCCOC1=C(C=CC=C1OC)CCNC(=O)[C@H]2CCCC[C@H]2C(=O)O

InChI

InChI=1S/C22H33NO5/c1-3-4-7-15-28-20-16(9-8-12-19(20)27-2)13-14-23-21(24)17-10-5-6-11-18(17)22(25)26/h8-9,12,17-18H,3-7,10-11,13-15H2,1-2H3,(H,23,24)(H,25,26)/t17-,18+/m0/s1