2-[(2S)-1-cyclopentyl-4-[(2,4-dimethoxy-3-methyl-phenyl)methyl]piperazin-1-ium-2-yl]ethanol

Systemtic Name: 2-[(2S)-1-cyclopentyl-4-[(2,4-dimethoxy-3-methyl-phenyl)methyl]piperazin-1-ium-2-yl]ethanol Openeye Name: 2-[(2S)-1-cyclopentyl-4-[(2,4-dimethoxy-3-methyl-phenyl)methyl]piperazin-1-ium-2-yl]ethanol CAS Name: 2-[(2S)-1-cyclopentyl-4-[(2,4-dimethoxy-3-methylphenyl)methyl]-2-piperazin-1-iumyl]ethanol IUPAC Name: 2-[(2S)-1-cyclopentyl-4-[(2,4-dimethoxy-3-methylphenyl)methyl]piperazin-1-ium-2-yl]ethanol Traditional Name: 2-[(2S)-1-cyclopentyl-4-(2,4-dimethoxy-3-methyl-benzyl)piperazin-1-ium-2-yl]ethanol Formula: C21H35N2O3+ MolecularWeight: 363.5142

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1OC)CN2CC[NH+](C(C2)CCO)C3CCCC3)OC

Isomeric SMILES

CC1=C(C=CC(=C1OC)CN2CC[NH+]([C@H](C2)CCO)C3CCCC3)OC

InChI

InChI=1S/C21H34N2O3/c1-16-20(25-2)9-8-17(21(16)26-3)14-22-11-12-23(18-6-4-5-7-18)19(15-22)10-13-24/h8-9,18-19,24H,4-7,10-15H2,1-3H3/p+1/t19-/m0/s1