2-[(2S)-1-cyclopentyl-4-[(2,5-dimethoxyphenyl)methyl]piperazin-1-ium-2-yl]ethanol

Systemtic Name: 2-[(2S)-1-cyclopentyl-4-[(2,5-dimethoxyphenyl)methyl]piperazin-1-ium-2-yl]ethanol Openeye Name: 2-[(2S)-1-cyclopentyl-4-[(2,5-dimethoxyphenyl)methyl]piperazin-1-ium-2-yl]ethanol CAS Name: 2-[(2S)-1-cyclopentyl-4-[(2,5-dimethoxyphenyl)methyl]-2-piperazin-1-iumyl]ethanol IUPAC Name: 2-[(2S)-1-cyclopentyl-4-[(2,5-dimethoxyphenyl)methyl]piperazin-1-ium-2-yl]ethanol Traditional Name: 2-[(2S)-1-cyclopentyl-4-(2,5-dimethoxybenzyl)piperazin-1-ium-2-yl]ethanol Formula: C20H33N2O3+ MolecularWeight: 349.48762

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)CN2CC[NH+](C(C2)CCO)C3CCCC3

Isomeric SMILES

COC1=CC(=C(C=C1)OC)CN2CC[NH+]([C@H](C2)CCO)C3CCCC3

InChI

InChI=1S/C20H32N2O3/c1-24-19-7-8-20(25-2)16(13-19)14-21-10-11-22(17-5-3-4-6-17)18(15-21)9-12-23/h7-8,13,17-18,23H,3-6,9-12,14-15H2,1-2H3/p+1/t18-/m0/s1