(1S,2R)-2-(4-pyrrolidin-1-ylbutylcarbamoyl)cyclohexane-1-carboxylic acid

Systemtic Name: (1S,2R)-2-(4-pyrrolidin-1-ylbutylcarbamoyl)cyclohexane-1-carboxylic acid Openeye Name: (1S,2R)-2-(4-pyrrolidin-1-ylbutylcarbamoyl)cyclohexanecarboxylic acid CAS Name: (1S,2R)-2-[oxo-[4-(1-pyrrolidinyl)butylamino]methyl]-1-cyclohexanecarboxylic acid IUPAC Name: (1S,2R)-2-(4-pyrrolidin-1-ylbutylcarbamoyl)cyclohexane-1-carboxylic acid Traditional Name: (1S,2R)-2-(4-pyrrolidinobutylcarbamoyl)cyclohexanecarboxylic acid Formula: C16H28N2O3 MolecularWeight: 296.40512

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)C(=O)NCCCCN2CCCC2)C(=O)O

Isomeric SMILES

C1CC[C@@H]([C@@H](C1)C(=O)NCCCCN2CCCC2)C(=O)O

InChI

InChI=1S/C16H28N2O3/c19-15(13-7-1-2-8-14(13)16(20)21)17-9-3-4-10-18-11-5-6-12-18/h13-14H,1-12H2,(H,17,19)(H,20,21)/t13-,14+/m1/s1