2-[4-[1-[(3,4-dimethoxyphenyl)methyl]piperidin-1-ium-4-yl]piperazin-4-ium-1-yl]ethanol

Systemtic Name: 2-[4-[1-[(3,4-dimethoxyphenyl)methyl]piperidin-1-ium-4-yl]piperazin-4-ium-1-yl]ethanol Openeye Name: 2-[4-[1-[(3,4-dimethoxyphenyl)methyl]piperidin-1-ium-4-yl]piperazin-4-ium-1-yl]ethanol CAS Name: 2-[4-[1-[(3,4-dimethoxyphenyl)methyl]-4-piperidin-1-iumyl]-1-piperazin-4-iumyl]ethanol IUPAC Name: 2-[4-[1-[(3,4-dimethoxyphenyl)methyl]piperidin-1-ium-4-yl]piperazin-4-ium-1-yl]ethanol Traditional Name: 2-[4-(1-veratrylpiperidin-1-ium-4-yl)piperazin-4-ium-1-yl]ethanol Formula: C20H35N3O3+2 MolecularWeight: 365.5102

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C[NH+]2CCC(CC2)[NH+]3CCN(CC3)CCO)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C[NH+]2CCC(CC2)[NH+]3CCN(CC3)CCO)OC

InChI

InChI=1S/C20H33N3O3/c1-25-19-4-3-17(15-20(19)26-2)16-22-7-5-18(6-8-22)23-11-9-21(10-12-23)13-14-24/h3-4,15,18,24H,5-14,16H2,1-2H3/p+2