(1R,2R)-2-[2-(3,4-dimethoxyphenyl)ethylcarbamoyl]cyclohexane-1-carboxylate

Systemtic Name: (1R,2R)-2-[2-(3,4-dimethoxyphenyl)ethylcarbamoyl]cyclohexane-1-carboxylate Openeye Name: (1R,2R)-2-[2-(3,4-dimethoxyphenyl)ethylcarbamoyl]cyclohexanecarboxylate CAS Name: (1R,2R)-2-[[2-(3,4-dimethoxyphenyl)ethylamino]-oxomethyl]-1-cyclohexanecarboxylate IUPAC Name: (1R,2R)-2-[2-(3,4-dimethoxyphenyl)ethylcarbamoyl]cyclohexane-1-carboxylate Traditional Name: (1R,2R)-2-(homoveratrylcarbamoyl)cyclohexanecarboxylate Formula: C18H24NO5- MolecularWeight: 334.38686

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=O)C2CCCCC2C(=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=O)[C@@H]2CCCC[C@H]2C(=O)[O-])OC

InChI

InChI=1S/C18H25NO5/c1-23-15-8-7-12(11-16(15)24-2)9-10-19-17(20)13-5-3-4-6-14(13)18(21)22/h7-8,11,13-14H,3-6,9-10H2,1-2H3,(H,19,20)(H,21,22)/p-1/t13-,14-/m1/s1