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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C(=O)O)CN2CCC(CC2)C3=CN(C4=C3C=C(C=C4)OC)CC5=CC=CO5

Isomeric SMILES

COC1=CC(=C(C=C1)C(=O)O)CN2CCC(CC2)C3=CN(C4=C3C=C(C=C4)OC)CC5=CC=CO5

InChI

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