2-[2-[4-[1-(2-methylpropyl)indol-3-yl]piperidin-1-yl]ethoxy]benzoic acid

Systemtic Name: 2-[2-[4-[1-(2-methylpropyl)indol-3-yl]piperidin-1-yl]ethoxy]benzoic acid Openeye Name: 2-[2-[4-(1-isobutylindol-3-yl)-1-piperidyl]ethoxy]benzoic acid CAS Name: 2-[2-[4-[1-(2-methylpropyl)-3-indolyl]-1-piperidinyl]ethoxy]benzoic acid IUPAC Name: 2-[2-[4-[1-(2-methylpropyl)indol-3-yl]piperidin-1-yl]ethoxy]benzoic acid Traditional Name: 2-[2-[4-(1-isobutylindol-3-yl)piperidino]ethoxy]benzoic acid Formula: C26H32N2O3 MolecularWeight: 420.54388

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C=C(C2=CC=CC=C21)C3CCN(CC3)CCOC4=CC=CC=C4C(=O)O

Isomeric SMILES

CC(C)CN1C=C(C2=CC=CC=C21)C3CCN(CC3)CCOC4=CC=CC=C4C(=O)O

InChI

InChI=1S/C26H32N2O3/c1-19(2)17-28-18-23(21-7-3-5-9-24(21)28)20-11-13-27(14-12-20)15-16-31-25-10-6-4-8-22(25)26(29)30/h3-10,18-20H,11-17H2,1-2H3,(H,29,30)