N-phenethyl-2-[4-[(2,3,4-trimethoxyphenyl)methyl]piperazine-1,4-diium-1-yl]ethanamide

Systemtic Name: N-phenethyl-2-[4-[(2,3,4-trimethoxyphenyl)methyl]piperazine-1,4-diium-1-yl]ethanamide Openeye Name: N-phenethyl-2-[4-[(2,3,4-trimethoxyphenyl)methyl]piperazine-1,4-diium-1-yl]acetamide CAS Name: N-phenethyl-2-[4-[(2,3,4-trimethoxyphenyl)methyl]-1-piperazine-1,4-diiumyl]acetamide IUPAC Name: N-phenethyl-2-[4-[(2,3,4-trimethoxyphenyl)methyl]piperazine-1,4-diium-1-yl]acetamide Traditional Name: N-phenethyl-2-[4-(2,3,4-trimethoxybenzyl)piperazine-1,4-diium-1-yl]acetamide Formula: C24H35N3O4+2 MolecularWeight: 429.5524

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)C[NH+]2CC[NH+](CC2)CC(=O)NCCC3=CC=CC=C3)OC)OC

Isomeric SMILES

COC1=C(C(=C(C=C1)C[NH+]2CC[NH+](CC2)CC(=O)NCCC3=CC=CC=C3)OC)OC

InChI

InChI=1S/C24H33N3O4/c1-29-21-10-9-20(23(30-2)24(21)31-3)17-26-13-15-27(16-14-26)18-22(28)25-12-11-19-7-5-4-6-8-19/h4-10H,11-18H2,1-3H3,(H,25,28)/p+2