1-cycloheptyl-4-[(3,4,5-trimethoxyphenyl)methyl]piperazin-1-ium

Systemtic Name: 1-cycloheptyl-4-[(3,4,5-trimethoxyphenyl)methyl]piperazin-1-ium Openeye Name: 1-cycloheptyl-4-[(3,4,5-trimethoxyphenyl)methyl]piperazin-1-ium CAS Name: 1-cycloheptyl-4-[(3,4,5-trimethoxyphenyl)methyl]piperazin-1-ium IUPAC Name: 1-cycloheptyl-4-[(3,4,5-trimethoxyphenyl)methyl]piperazin-1-ium Traditional Name: 1-cycloheptyl-4-(3,4,5-trimethoxybenzyl)piperazin-1-ium Formula: C21H35N2O3+ MolecularWeight: 363.5142

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)CN2CC[NH+](CC2)C3CCCCCC3

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)CN2CC[NH+](CC2)C3CCCCCC3

InChI

InChI=1S/C21H34N2O3/c1-24-19-14-17(15-20(25-2)21(19)26-3)16-22-10-12-23(13-11-22)18-8-6-4-5-7-9-18/h14-15,18H,4-13,16H2,1-3H3/p+1