3-[3-[4-(2,3-dihydro-1,4-benzodioxin-5-yl)piperazin-1-yl]-1-oxidanyl-propyl]-1-benzothiophen-5-ol

Systemtic Name: 3-[3-[4-(2,3-dihydro-1,4-benzodioxin-5-yl)piperazin-1-yl]-1-oxidanyl-propyl]-1-benzothiophen-5-ol Openeye Name: 3-[3-[4-(2,3-dihydro-1,4-benzodioxin-5-yl)piperazin-1-yl]-1-hydroxy-propyl]benzothiophen-5-ol CAS Name: 3-[3-[4-(2,3-dihydro-1,4-benzodioxin-5-yl)-1-piperazinyl]-1-hydroxypropyl]-1-benzothiophen-5-ol IUPAC Name: 3-[3-[4-(2,3-dihydro-1,4-benzodioxin-5-yl)piperazin-1-yl]-1-hydroxypropyl]-1-benzothiophen-5-ol Traditional Name: 3-[3-[4-(2,3-dihydro-1,4-benzodioxin-5-yl)piperazino]-1-hydroxy-propyl]benzothiophen-5-ol Formula: C23H26N2O4S MolecularWeight: 426.52854

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC(C2=CSC3=C2C=C(C=C3)O)O)C4=C5C(=CC=C4)OCCO5

Isomeric SMILES

C1CN(CCN1CCC(C2=CSC3=C2C=C(C=C3)O)O)C4=C5C(=CC=C4)OCCO5

InChI

InChI=1S/C23H26N2O4S/c26-16-4-5-22-17(14-16)18(15-30-22)20(27)6-7-24-8-10-25(11-9-24)19-2-1-3-21-23(19)29-13-12-28-21/h1-5,14-15,20,26-27H,6-13H2