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1-cycloheptyl-4-[(2,3,4-trimethoxyphenyl)methyl]piperazine-1,4-diium

1-cycloheptyl-4-[(2,3,4-trimethoxyphenyl)methyl]piperazine-1,4-diium

Systemtic Name:1-cycloheptyl-4-[(2,3,4-trimethoxyphenyl)methyl]piperazine-1,4-diium
Openeye Name:1-cycloheptyl-4-[(2,3,4-trimethoxyphenyl)methyl]piperazine-1,4-diium
CAS Name:1-cycloheptyl-4-[(2,3,4-trimethoxyphenyl)methyl]piperazine-1,4-diium
IUPAC Name:1-cycloheptyl-4-[(2,3,4-trimethoxyphenyl)methyl]piperazine-1,4-diium
Traditional Name:1-cycloheptyl-4-(2,3,4-trimethoxybenzyl)piperazine-1,4-diium
Formula: C21H36N2O3+2
MolecularWeight: 364.52214
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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)C[NH+]2CC[NH+](CC2)C3CCCCCC3)OC)OC


Isomeric SMILES

COC1=C(C(=C(C=C1)C[NH+]2CC[NH+](CC2)C3CCCCCC3)OC)OC


InChI

InChI=1S/C21H34N2O3/c1-24-19-11-10-17(20(25-2)21(19)26-3)16-22-12-14-23(15-13-22)18-8-6-4-5-7-9-18/h10-11,18H,4-9,12-16H2,1-3H3/p+2


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