(2S)-1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-3-butoxy-propan-2-ol

Systemtic Name: (2S)-1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-3-butoxy-propan-2-ol Openeye Name: (2S)-1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-3-butoxy-propan-2-ol CAS Name: (2S)-1-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-3-butoxy-2-propanol IUPAC Name: (2S)-1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-3-butoxypropan-2-ol Traditional Name: (2S)-1-butoxy-3-(4-piperonylpiperazino)propan-2-ol Formula: C19H30N2O4 MolecularWeight: 350.4525

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOCC(CN1CCN(CC1)CC2=CC3=C(C=C2)OCO3)O

Isomeric SMILES

CCCCOC[C@H](CN1CCN(CC1)CC2=CC3=C(C=C2)OCO3)O

InChI

InChI=1S/C19H30N2O4/c1-2-3-10-23-14-17(22)13-21-8-6-20(7-9-21)12-16-4-5-18-19(11-16)25-15-24-18/h4-5,11,17,22H,2-3,6-10,12-15H2,1H3/t17-/m0/s1