ethyl 4-[2-oxidanyl-3-[4-(pyridin-2-yloxymethyl)piperidin-1-yl]propoxy]-1H-indole-2-carboxylate

Systemtic Name: ethyl 4-[2-oxidanyl-3-[4-(pyridin-2-yloxymethyl)piperidin-1-yl]propoxy]-1H-indole-2-carboxylate Openeye Name: ethyl 4-[2-hydroxy-3-[4-(2-pyridyloxymethyl)-1-piperidyl]propoxy]-1H-indole-2-carboxylate CAS Name: 4-[2-hydroxy-3-[4-(2-pyridinyloxymethyl)-1-piperidinyl]propoxy]-1H-indole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-hydroxy-3-[4-(pyridin-2-yloxymethyl)piperidin-1-yl]propoxy]-1H-indole-2-carboxylate Traditional Name: 4-[2-hydroxy-3-[4-(2-pyridyloxymethyl)piperidino]propoxy]-1H-indole-2-carboxylic acid ethyl ester Formula: C25H31N3O5 MolecularWeight: 453.53074

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(N1)C=CC=C2OCC(CN3CCC(CC3)COC4=CC=CC=N4)O

Isomeric SMILES

CCOC(=O)C1=CC2=C(N1)C=CC=C2OCC(CN3CCC(CC3)COC4=CC=CC=N4)O

InChI

InChI=1S/C25H31N3O5/c1-2-31-25(30)22-14-20-21(27-22)6-5-7-23(20)32-17-19(29)15-28-12-9-18(10-13-28)16-33-24-8-3-4-11-26-24/h3-8,11,14,18-19,27,29H,2,9-10,12-13,15-17H2,1H3