1-[4-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)piperazin-1-yl]-3-(3-methylphenoxy)propan-2-ol

Systemtic Name: 1-[4-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)piperazin-1-yl]-3-(3-methylphenoxy)propan-2-ol Openeye Name: 1-[4-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)piperazin-1-yl]-3-(3-methylphenoxy)propan-2-ol CAS Name: 1-[4-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-1-piperazinyl]-3-(3-methylphenoxy)-2-propanol IUPAC Name: 1-[4-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)piperazin-1-yl]-3-(3-methylphenoxy)propan-2-ol Traditional Name: 1-[4-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)piperazino]-3-(3-methylphenoxy)propan-2-ol Formula: C23H30N2O4 MolecularWeight: 398.4953

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCC(CN2CCN(CC2)CC3=CC4=C(C=C3)OCCO4)O

Isomeric SMILES

CC1=CC(=CC=C1)OCC(CN2CCN(CC2)CC3=CC4=C(C=C3)OCCO4)O

InChI

InChI=1S/C23H30N2O4/c1-18-3-2-4-21(13-18)29-17-20(26)16-25-9-7-24(8-10-25)15-19-5-6-22-23(14-19)28-12-11-27-22/h2-6,13-14,20,26H,7-12,15-17H2,1H3