4-(1H-indol-4-yl)-1-[2-oxidanyl-3-(2-prop-2-enoxyphenoxy)propyl]piperidin-4-ol hydrochloride

Systemtic Name: 4-(1H-indol-4-yl)-1-[2-oxidanyl-3-(2-prop-2-enoxyphenoxy)propyl]piperidin-4-ol hydrochloride Openeye Name: 1-[3-(2-allyloxyphenoxy)-2-hydroxy-propyl]-4-(1H-indol-4-yl)piperidin-4-ol hydrochloride CAS Name: 1-[2-hydroxy-3-(2-prop-2-enoxyphenoxy)propyl]-4-(1H-indol-4-yl)-4-piperidinol hydrochloride IUPAC Name: 1-[2-hydroxy-3-(2-prop-2-enoxyphenoxy)propyl]-4-(1H-indol-4-yl)piperidin-4-ol hydrochloride Traditional Name: 1-[3-(2-allyloxyphenoxy)-2-hydroxy-propyl]-4-(1H-indol-4-yl)piperidin-4-ol hydrochloride Formula: C25H31ClN2O4 MolecularWeight: 458.97764

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Descriptors Computed from Structure

Canonical SMILES:

C=CCOC1=CC=CC=C1OCC(CN2CCC(CC2)(C3=C4C=CNC4=CC=C3)O)O.Cl

Isomeric SMILES

C=CCOC1=CC=CC=C1OCC(CN2CCC(CC2)(C3=C4C=CNC4=CC=C3)O)O.Cl

InChI

InChI=1S/C25H30N2O4.ClH/c1-2-16-30-23-8-3-4-9-24(23)31-18-19(28)17-27-14-11-25(29,12-15-27)21-6-5-7-22-20(21)10-13-26-22;/h2-10,13,19,26,28-29H,1,11-12,14-18H2;1H