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

Systemtic Name: 2-[(2S)-1-methyl-4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-ium-2-yl]ethanol Openeye Name: 2-[(2S)-1-methyl-4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-ium-2-yl]ethanol CAS Name: 2-[(2S)-1-methyl-4-[(2,3,4-trimethoxyphenyl)methyl]-2-piperazin-1-iumyl]ethanol IUPAC Name: 2-[(2S)-1-methyl-4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-ium-2-yl]ethanol Traditional Name: 2-[(2S)-1-methyl-4-(2,3,4-trimethoxybenzyl)piperazin-1-ium-2-yl]ethanol Formula: C17H29N2O4+ MolecularWeight: 325.42316

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1CCO)CC2=C(C(=C(C=C2)OC)OC)OC

Isomeric SMILES

C[NH+]1CCN(C[C@@H]1CCO)CC2=C(C(=C(C=C2)OC)OC)OC

InChI

InChI=1S/C17H28N2O4/c1-18-8-9-19(12-14(18)7-10-20)11-13-5-6-15(21-2)17(23-4)16(13)22-3/h5-6,14,20H,7-12H2,1-4H3/p+1/t14-/m0/s1