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

Systemtic Name: 1-(3-phenylpropyl)-4-[(3,4,5-trimethoxyphenyl)methyl]piperazin-1-ium Openeye Name: 1-(3-phenylpropyl)-4-[(3,4,5-trimethoxyphenyl)methyl]piperazin-1-ium CAS Name: 1-(3-phenylpropyl)-4-[(3,4,5-trimethoxyphenyl)methyl]piperazin-1-ium IUPAC Name: 1-(3-phenylpropyl)-4-[(3,4,5-trimethoxyphenyl)methyl]piperazin-1-ium Traditional Name: 1-(3-phenylpropyl)-4-(3,4,5-trimethoxybenzyl)piperazin-1-ium Formula: C23H33N2O3+ MolecularWeight: 385.51972

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)CN2CC[NH+](CC2)CCCC3=CC=CC=C3

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)CN2CC[NH+](CC2)CCCC3=CC=CC=C3

InChI

InChI=1S/C23H32N2O3/c1-26-21-16-20(17-22(27-2)23(21)28-3)18-25-14-12-24(13-15-25)11-7-10-19-8-5-4-6-9-19/h4-6,8-9,16-17H,7,10-15,18H2,1-3H3/p+1