(1R,2S)-2-[(3-propoxyphenyl)methylcarbamoyl]cyclohexane-1-carboxylic acid

Systemtic Name: (1R,2S)-2-[(3-propoxyphenyl)methylcarbamoyl]cyclohexane-1-carboxylic acid Openeye Name: (1R,2S)-2-[(3-propoxyphenyl)methylcarbamoyl]cyclohexanecarboxylic acid CAS Name: (1R,2S)-2-[oxo-[(3-propoxyphenyl)methylamino]methyl]-1-cyclohexanecarboxylic acid IUPAC Name: (1R,2S)-2-[(3-propoxyphenyl)methylcarbamoyl]cyclohexane-1-carboxylic acid Traditional Name: (1R,2S)-2-[(3-propoxybenzyl)carbamoyl]cyclohexanecarboxylic acid Formula: C18H25NO4 MolecularWeight: 319.3954

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC(=C1)CNC(=O)C2CCCCC2C(=O)O

Isomeric SMILES

CCCOC1=CC=CC(=C1)CNC(=O)[C@H]2CCCC[C@H]2C(=O)O

InChI

InChI=1S/C18H25NO4/c1-2-10-23-14-7-5-6-13(11-14)12-19-17(20)15-8-3-4-9-16(15)18(21)22/h5-7,11,15-16H,2-4,8-10,12H2,1H3,(H,19,20)(H,21,22)/t15-,16+/m0/s1