methyl 3-[4-[4-(2,3-dihydro-1-benzofuran-5-yl)-4-oxidanyl-piperidin-1-yl]butyl]-1H-indole-5-carboxylate

Systemtic Name: methyl 3-[4-[4-(2,3-dihydro-1-benzofuran-5-yl)-4-oxidanyl-piperidin-1-yl]butyl]-1H-indole-5-carboxylate Openeye Name: methyl 3-[4-[4-(2,3-dihydrobenzofuran-5-yl)-4-hydroxy-1-piperidyl]butyl]-1H-indole-5-carboxylate CAS Name: 3-[4-[4-(2,3-dihydrobenzofuran-5-yl)-4-hydroxy-1-piperidinyl]butyl]-1H-indole-5-carboxylic acid methyl ester IUPAC Name: methyl 3-[4-[4-(2,3-dihydro-1-benzofuran-5-yl)-4-hydroxypiperidin-1-yl]butyl]-1H-indole-5-carboxylate Traditional Name: 3-[4-(4-coumaran-5-yl-4-hydroxy-piperidino)butyl]-1H-indole-5-carboxylic acid methyl ester Formula: C27H32N2O4 MolecularWeight: 448.55398

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)NC=C2CCCCN3CCC(CC3)(C4=CC5=C(C=C4)OCC5)O

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)NC=C2CCCCN3CCC(CC3)(C4=CC5=C(C=C4)OCC5)O

InChI

InChI=1S/C27H32N2O4/c1-32-26(30)20-5-7-24-23(17-20)21(18-28-24)4-2-3-12-29-13-10-27(31,11-14-29)22-6-8-25-19(16-22)9-15-33-25/h5-8,16-18,28,31H,2-4,9-15H2,1H3