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

Systemtic Name: 2-[4-[(3,4-dimethoxyphenyl)methyl]piperazine-1,4-diium-1-yl]-N-naphthalen-2-yl-ethanamide Openeye Name: 2-[4-[(3,4-dimethoxyphenyl)methyl]piperazine-1,4-diium-1-yl]-N-(2-naphthyl)acetamide CAS Name: 2-[4-[(3,4-dimethoxyphenyl)methyl]-1-piperazine-1,4-diiumyl]-N-(2-naphthalenyl)acetamide IUPAC Name: 2-[4-[(3,4-dimethoxyphenyl)methyl]piperazine-1,4-diium-1-yl]-N-naphthalen-2-ylacetamide Traditional Name: N-(2-naphthyl)-2-(4-veratrylpiperazine-1,4-diium-1-yl)acetamide Formula: C25H31N3O3+2 MolecularWeight: 421.53194

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C[NH+]2CC[NH+](CC2)CC(=O)NC3=CC4=CC=CC=C4C=C3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C[NH+]2CC[NH+](CC2)CC(=O)NC3=CC4=CC=CC=C4C=C3)OC

InChI

InChI=1S/C25H29N3O3/c1-30-23-10-7-19(15-24(23)31-2)17-27-11-13-28(14-12-27)18-25(29)26-22-9-8-20-5-3-4-6-21(20)16-22/h3-10,15-16H,11-14,17-18H2,1-2H3,(H,26,29)/p+2