3-[[4-(5-chloranyl-1-ethyl-indol-3-yl)piperidin-1-yl]methyl]-2-methoxy-benzoic acid

Systemtic Name: 3-[[4-(5-chloranyl-1-ethyl-indol-3-yl)piperidin-1-yl]methyl]-2-methoxy-benzoic acid Openeye Name: 3-[[4-(5-chloro-1-ethyl-indol-3-yl)-1-piperidyl]methyl]-2-methoxy-benzoic acid CAS Name: 3-[[4-(5-chloro-1-ethyl-3-indolyl)-1-piperidinyl]methyl]-2-methoxybenzoic acid IUPAC Name: 3-[[4-(5-chloro-1-ethylindol-3-yl)piperidin-1-yl]methyl]-2-methoxybenzoic acid Traditional Name: 3-[[4-(5-chloro-1-ethyl-indol-3-yl)piperidino]methyl]-2-methoxy-benzoic acid Formula: C24H27ClN2O3 MolecularWeight: 426.93578

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C2=C1C=CC(=C2)Cl)C3CCN(CC3)CC4=CC=CC(=C4OC)C(=O)O

Isomeric SMILES

CCN1C=C(C2=C1C=CC(=C2)Cl)C3CCN(CC3)CC4=CC=CC(=C4OC)C(=O)O

InChI

InChI=1S/C24H27ClN2O3/c1-3-27-15-21(20-13-18(25)7-8-22(20)27)16-9-11-26(12-10-16)14-17-5-4-6-19(24(28)29)23(17)30-2/h4-8,13,15-16H,3,9-12,14H2,1-2H3,(H,28,29)