1-(naphthalen-2-ylmethyl)-4-[(2,4,5-trimethoxyphenyl)methyl]piperazine-1,4-diium

Systemtic Name: 1-(naphthalen-2-ylmethyl)-4-[(2,4,5-trimethoxyphenyl)methyl]piperazine-1,4-diium Openeye Name: 1-(2-naphthylmethyl)-4-[(2,4,5-trimethoxyphenyl)methyl]piperazine-1,4-diium CAS Name: 1-(2-naphthalenylmethyl)-4-[(2,4,5-trimethoxyphenyl)methyl]piperazine-1,4-diium IUPAC Name: 1-(naphthalen-2-ylmethyl)-4-[(2,4,5-trimethoxyphenyl)methyl]piperazine-1,4-diium Traditional Name: 1-(2-naphthylmethyl)-4-(2,4,5-trimethoxybenzyl)piperazine-1,4-diium Formula: C25H32N2O3+2 MolecularWeight: 408.53318

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C[NH+]2CC[NH+](CC2)CC3=CC4=CC=CC=C4C=C3)OC)OC

Isomeric SMILES

COC1=CC(=C(C=C1C[NH+]2CC[NH+](CC2)CC3=CC4=CC=CC=C4C=C3)OC)OC

InChI

InChI=1S/C25H30N2O3/c1-28-23-16-25(30-3)24(29-2)15-22(23)18-27-12-10-26(11-13-27)17-19-8-9-20-6-4-5-7-21(20)14-19/h4-9,14-16H,10-13,17-18H2,1-3H3/p+2