ethyl 5-(2-oxidanyl-3-piperidin-1-yl-propoxy)-2-phenyl-1-benzofuran-3-carboxylate hydrochloride

Systemtic Name: ethyl 5-(2-oxidanyl-3-piperidin-1-yl-propoxy)-2-phenyl-1-benzofuran-3-carboxylate hydrochloride Openeye Name: ethyl 5-[2-hydroxy-3-(1-piperidyl)propoxy]-2-phenyl-benzofuran-3-carboxylate hydrochloride CAS Name: 5-[2-hydroxy-3-(1-piperidinyl)propoxy]-2-phenyl-3-benzofurancarboxylic acid ethyl ester hydrochloride IUPAC Name: ethyl 5-(2-hydroxy-3-piperidin-1-ylpropoxy)-2-phenyl-1-benzofuran-3-carboxylate hydrochloride Traditional Name: 5-(2-hydroxy-3-piperidino-propoxy)-2-phenyl-benzofuran-3-carboxylic acid ethyl ester hydrochloride Formula: C25H30ClNO5 MolecularWeight: 459.9624

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC2=C1C=C(C=C2)OCC(CN3CCCCC3)O)C4=CC=CC=C4.Cl

Isomeric SMILES

CCOC(=O)C1=C(OC2=C1C=C(C=C2)OCC(CN3CCCCC3)O)C4=CC=CC=C4.Cl

InChI

InChI=1S/C25H29NO5.ClH/c1-2-29-25(28)23-21-15-20(30-17-19(27)16-26-13-7-4-8-14-26)11-12-22(21)31-24(23)18-9-5-3-6-10-18;/h3,5-6,9-12,15,19,27H,2,4,7-8,13-14,16-17H2,1H3;1H