5-[1-[4-(6-methoxycarbonyl-1H-indol-3-yl)butyl]-4-oxidanyl-piperidin-4-yl]-1-benzofuran-3-carboxylic acid

Systemtic Name: 5-[1-[4-(6-methoxycarbonyl-1H-indol-3-yl)butyl]-4-oxidanyl-piperidin-4-yl]-1-benzofuran-3-carboxylic acid Openeye Name: 5-[4-hydroxy-1-[4-(6-methoxycarbonyl-1H-indol-3-yl)butyl]-4-piperidyl]benzofuran-3-carboxylic acid CAS Name: 5-[4-hydroxy-1-[4-(6-methoxycarbonyl-1H-indol-3-yl)butyl]-4-piperidinyl]-3-benzofurancarboxylic acid IUPAC Name: 5-[4-hydroxy-1-[4-(6-methoxycarbonyl-1H-indol-3-yl)butyl]piperidin-4-yl]-1-benzofuran-3-carboxylic acid Traditional Name: 5-[1-[4-(6-carbomethoxy-1H-indol-3-yl)butyl]-4-hydroxy-4-piperidyl]benzofuran-3-carboxylic acid Formula: C28H30N2O6 MolecularWeight: 490.5476

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)C(=CN2)CCCCN3CCC(CC3)(C4=CC5=C(C=C4)OC=C5C(=O)O)O

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)C(=CN2)CCCCN3CCC(CC3)(C4=CC5=C(C=C4)OC=C5C(=O)O)O

InChI

InChI=1S/C28H30N2O6/c1-35-27(33)18-5-7-21-19(16-29-24(21)14-18)4-2-3-11-30-12-9-28(34,10-13-30)20-6-8-25-22(15-20)23(17-36-25)26(31)32/h5-8,14-17,29,34H,2-4,9-13H2,1H3,(H,31,32)