2-[4-(1,3-benzodioxol-4-ylmethyl)-1-(thiophen-3-ylmethyl)piperazin-2-yl]ethanol

Systemtic Name: 2-[4-(1,3-benzodioxol-4-ylmethyl)-1-(thiophen-3-ylmethyl)piperazin-2-yl]ethanol Openeye Name: 2-[4-(1,3-benzodioxol-4-ylmethyl)-1-(3-thienylmethyl)piperazin-2-yl]ethanol CAS Name: 2-[4-(1,3-benzodioxol-4-ylmethyl)-1-(3-thiophenylmethyl)-2-piperazinyl]ethanol IUPAC Name: 2-[4-(1,3-benzodioxol-4-ylmethyl)-1-(thiophen-3-ylmethyl)piperazin-2-yl]ethanol Traditional Name: 2-[4-(1,3-benzodioxol-4-ylmethyl)-1-(3-thenyl)piperazin-2-yl]ethanol Formula: C19H24N2O3S MolecularWeight: 360.47046

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(CN1CC2=C3C(=CC=C2)OCO3)CCO)CC4=CSC=C4

Isomeric SMILES

C1CN(C(CN1CC2=C3C(=CC=C2)OCO3)CCO)CC4=CSC=C4

InChI

InChI=1S/C19H24N2O3S/c22-8-4-17-12-20(6-7-21(17)10-15-5-9-25-13-15)11-16-2-1-3-18-19(16)24-14-23-18/h1-3,5,9,13,17,22H,4,6-8,10-12,14H2