1-(phenylmethyl)-4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-ium

Systemtic Name: 1-(phenylmethyl)-4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-ium Openeye Name: 1-benzyl-4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-ium CAS Name: 1-(phenylmethyl)-4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-ium IUPAC Name: 1-benzyl-4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-ium Traditional Name: 1-benzyl-4-(2,3,4-trimethoxybenzyl)piperazin-1-ium Formula: C21H29N2O3+ MolecularWeight: 357.46656

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)CN2CC[NH+](CC2)CC3=CC=CC=C3)OC)OC

Isomeric SMILES

COC1=C(C(=C(C=C1)CN2CC[NH+](CC2)CC3=CC=CC=C3)OC)OC

InChI

InChI=1S/C21H28N2O3/c1-24-19-10-9-18(20(25-2)21(19)26-3)16-23-13-11-22(12-14-23)15-17-7-5-4-6-8-17/h4-10H,11-16H2,1-3H3/p+1