(1R,2S)-2-[[2-(2-diethylaminoethyloxy)phenyl]methylcarbamoyl]cyclohexane-1-carboxylic acid

Systemtic Name: (1R,2S)-2-[[2-(2-diethylaminoethyloxy)phenyl]methylcarbamoyl]cyclohexane-1-carboxylic acid Openeye Name: (1R,2S)-2-[[2-(2-diethylaminoethyloxy)phenyl]methylcarbamoyl]cyclohexanecarboxylic acid CAS Name: (1R,2S)-2-[[[2-(2-diethylaminoethyloxy)phenyl]methylamino]-oxomethyl]-1-cyclohexanecarboxylic acid IUPAC Name: (1R,2S)-2-[[2-(2-diethylaminoethyloxy)phenyl]methylcarbamoyl]cyclohexane-1-carboxylic acid Traditional Name: (1R,2S)-2-[[2-(2-diethylaminoethyloxy)benzyl]carbamoyl]cyclohexanecarboxylic acid Formula: C21H32N2O4 MolecularWeight: 376.48978

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCOC1=CC=CC=C1CNC(=O)C2CCCCC2C(=O)O

Isomeric SMILES

CCN(CC)CCOC1=CC=CC=C1CNC(=O)[C@H]2CCCC[C@H]2C(=O)O

InChI

InChI=1S/C21H32N2O4/c1-3-23(4-2)13-14-27-19-12-8-5-9-16(19)15-22-20(24)17-10-6-7-11-18(17)21(25)26/h5,8-9,12,17-18H,3-4,6-7,10-11,13-15H2,1-2H3,(H,22,24)(H,25,26)/t17-,18+/m0/s1