1-[3-(1-benzothiophen-4-yloxy)-3-oxidanyl-propyl]-4-quinolin-3-yl-piperidin-4-ol

Systemtic Name: 1-[3-(1-benzothiophen-4-yloxy)-3-oxidanyl-propyl]-4-quinolin-3-yl-piperidin-4-ol Openeye Name: 1-[3-(benzothiophen-4-yloxy)-3-hydroxy-propyl]-4-(3-quinolyl)piperidin-4-ol CAS Name: 1-[3-(1-benzothiophen-4-yloxy)-3-hydroxypropyl]-4-(3-quinolinyl)-4-piperidinol IUPAC Name: 1-[3-(1-benzothiophen-4-yloxy)-3-hydroxypropyl]-4-quinolin-3-ylpiperidin-4-ol Traditional Name: 1-[3-(benzothiophen-4-yloxy)-3-hydroxy-propyl]-4-(3-quinolyl)piperidin-4-ol Formula: C25H26N2O3S MolecularWeight: 434.55054

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1(C2=CC3=CC=CC=C3N=C2)O)CCC(O)OC4=C5C=CSC5=CC=C4

Isomeric SMILES

C1CN(CCC1(C2=CC3=CC=CC=C3N=C2)O)CCC(O)OC4=C5C=CSC5=CC=C4

InChI

InChI=1S/C25H26N2O3S/c28-24(30-22-6-3-7-23-20(22)9-15-31-23)8-12-27-13-10-25(29,11-14-27)19-16-18-4-1-2-5-21(18)26-17-19/h1-7,9,15-17,24,28-29H,8,10-14H2