4-[4-(2-oxidanylidene-3-piperidin-4-yl-imidazolidin-1-yl)phenyl]cyclohexane-1-carboxylic acid

Systemtic Name: 4-[4-(2-oxidanylidene-3-piperidin-4-yl-imidazolidin-1-yl)phenyl]cyclohexane-1-carboxylic acid Openeye Name: 4-[4-[2-oxo-3-(4-piperidyl)imidazolidin-1-yl]phenyl]cyclohexanecarboxylic acid CAS Name: 4-[4-[2-oxo-3-(4-piperidinyl)-1-imidazolidinyl]phenyl]-1-cyclohexanecarboxylic acid IUPAC Name: 4-[4-(2-oxo-3-piperidin-4-ylimidazolidin-1-yl)phenyl]cyclohexane-1-carboxylic acid Traditional Name: 4-[4-[2-keto-3-(4-piperidyl)imidazolidin-1-yl]phenyl]cyclohexanecarboxylic acid Formula: C21H29N3O3 MolecularWeight: 371.47326

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1C2=CC=C(C=C2)N3CCN(C3=O)C4CCNCC4)C(=O)O

Isomeric SMILES

C1CC(CCC1C2=CC=C(C=C2)N3CCN(C3=O)C4CCNCC4)C(=O)O

InChI

InChI=1S/C21H29N3O3/c25-20(26)17-3-1-15(2-4-17)16-5-7-18(8-6-16)23-13-14-24(21(23)27)19-9-11-22-12-10-19/h5-8,15,17,19,22H,1-4,9-14H2,(H,25,26)