2-[(2S)-1-cyclopentyl-4-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)piperazin-1-ium-2-yl]ethanol

Systemtic Name: 2-[(2S)-1-cyclopentyl-4-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)piperazin-1-ium-2-yl]ethanol Openeye Name: 2-[(2S)-1-cyclopentyl-4-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)piperazin-1-ium-2-yl]ethanol CAS Name: 2-[(2S)-1-cyclopentyl-4-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-2-piperazin-1-iumyl]ethanol IUPAC Name: 2-[(2S)-1-cyclopentyl-4-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)piperazin-1-ium-2-yl]ethanol Traditional Name: 2-[(2S)-1-cyclopentyl-4-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)piperazin-1-ium-2-yl]ethanol Formula: C20H31N2O3+ MolecularWeight: 347.47174

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)[NH+]2CCN(CC2CCO)CC3=CC4=C(C=C3)OCCO4

Isomeric SMILES

C1CCC(C1)[NH+]2CCN(C[C@@H]2CCO)CC3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C20H30N2O3/c23-10-7-18-15-21(8-9-22(18)17-3-1-2-4-17)14-16-5-6-19-20(13-16)25-12-11-24-19/h5-6,13,17-18,23H,1-4,7-12,14-15H2/p+1/t18-/m0/s1