(2S)-2-(1,3-benzodioxol-5-ylmethyl)-3-(4-methylpiperazin-1-yl)propan-1-amine

Systemtic Name: (2S)-2-(1,3-benzodioxol-5-ylmethyl)-3-(4-methylpiperazin-1-yl)propan-1-amine Openeye Name: (2S)-2-(1,3-benzodioxol-5-ylmethyl)-3-(4-methylpiperazin-1-yl)propan-1-amine CAS Name: (2S)-2-(1,3-benzodioxol-5-ylmethyl)-3-(4-methyl-1-piperazinyl)-1-propanamine IUPAC Name: (2S)-2-(1,3-benzodioxol-5-ylmethyl)-3-(4-methylpiperazin-1-yl)propan-1-amine Traditional Name: [(2S)-3-(1,3-benzodioxol-5-yl)-2-[(4-methylpiperazino)methyl]propyl]amine Formula: C16H25N3O2 MolecularWeight: 291.3886

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CC(CC2=CC3=C(C=C2)OCO3)CN

Isomeric SMILES

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

InChI

InChI=1S/C16H25N3O2/c1-18-4-6-19(7-5-18)11-14(10-17)8-13-2-3-15-16(9-13)21-12-20-15/h2-3,9,14H,4-8,10-12,17H2,1H3/t14-/m0/s1