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

Systemtic Name: 5-[[4-[1-(furan-2-ylmethyl)-5-methoxy-indol-3-yl]piperidin-1-yl]methyl]-2-methoxy-benzoic acid Openeye Name: 5-[[4-[1-(2-furylmethyl)-5-methoxy-indol-3-yl]-1-piperidyl]methyl]-2-methoxy-benzoic acid CAS Name: 5-[[4-[1-(2-furanylmethyl)-5-methoxy-3-indolyl]-1-piperidinyl]methyl]-2-methoxybenzoic acid IUPAC Name: 5-[[4-[1-(furan-2-ylmethyl)-5-methoxyindol-3-yl]piperidin-1-yl]methyl]-2-methoxybenzoic acid Traditional Name: 5-[[4-[1-(2-furfuryl)-5-methoxy-indol-3-yl]piperidino]methyl]-2-methoxy-benzoic acid Formula: C28H30N2O5 MolecularWeight: 474.5482

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N(C=C2C3CCN(CC3)CC4=CC(=C(C=C4)OC)C(=O)O)CC5=CC=CO5

Isomeric SMILES

COC1=CC2=C(C=C1)N(C=C2C3CCN(CC3)CC4=CC(=C(C=C4)OC)C(=O)O)CC5=CC=CO5

InChI

InChI=1S/C28H30N2O5/c1-33-21-6-7-26-23(15-21)25(18-30(26)17-22-4-3-13-35-22)20-9-11-29(12-10-20)16-19-5-8-27(34-2)24(14-19)28(31)32/h3-8,13-15,18,20H,9-12,16-17H2,1-2H3,(H,31,32)