2-[4-[4-(pyridin-4-ylamino)piperidin-1-yl]cyclohexyl]ethanoic acid

Systemtic Name: 2-[4-[4-(pyridin-4-ylamino)piperidin-1-yl]cyclohexyl]ethanoic acid Openeye Name: 2-[4-[4-(4-pyridylamino)-1-piperidyl]cyclohexyl]acetic acid CAS Name: 2-[4-[4-(pyridin-4-ylamino)-1-piperidinyl]cyclohexyl]acetic acid IUPAC Name: 2-[4-[4-(pyridin-4-ylamino)piperidin-1-yl]cyclohexyl]acetic acid Traditional Name: 2-[4-[4-(4-pyridylamino)piperidino]cyclohexyl]acetic acid Formula: C18H27N3O2 MolecularWeight: 317.42588

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1CC(=O)O)N2CCC(CC2)NC3=CC=NC=C3

Isomeric SMILES

C1CC(CCC1CC(=O)O)N2CCC(CC2)NC3=CC=NC=C3

InChI

InChI=1S/C18H27N3O2/c22-18(23)13-14-1-3-17(4-2-14)21-11-7-16(8-12-21)20-15-5-9-19-10-6-15/h5-6,9-10,14,16-17H,1-4,7-8,11-13H2,(H,19,20)(H,22,23)