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

Systemtic Name: (1R,2S)-2-[[2-(2-dimethylaminoethyloxy)-4-methoxy-phenyl]methylcarbamoyl]cyclohexane-1-carboxylic acid Openeye Name: (1R,2S)-2-[[2-(2-dimethylaminoethyloxy)-4-methoxy-phenyl]methylcarbamoyl]cyclohexanecarboxylic acid CAS Name: (1R,2S)-2-[[[2-(2-dimethylaminoethyloxy)-4-methoxyphenyl]methylamino]-oxomethyl]-1-cyclohexanecarboxylic acid IUPAC Name: (1R,2S)-2-[[2-(2-dimethylaminoethyloxy)-4-methoxyphenyl]methylcarbamoyl]cyclohexane-1-carboxylic acid Traditional Name: (1R,2S)-2-[[2-(2-dimethylaminoethyloxy)-4-methoxy-benzyl]carbamoyl]cyclohexanecarboxylic acid Formula: C20H30N2O5 MolecularWeight: 378.4626

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCOC1=C(C=CC(=C1)OC)CNC(=O)C2CCCCC2C(=O)O

Isomeric SMILES

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

InChI

InChI=1S/C20H30N2O5/c1-22(2)10-11-27-18-12-15(26-3)9-8-14(18)13-21-19(23)16-6-4-5-7-17(16)20(24)25/h8-9,12,16-17H,4-7,10-11,13H2,1-3H3,(H,21,23)(H,24,25)/t16-,17+/m0/s1