N-(2,6-dimethylphenyl)-2-[4-[(5-ethanoyl-2-ethoxy-phenyl)methyl]piperazine-1,4-diium-1-yl]ethanamide

Systemtic Name: N-(2,6-dimethylphenyl)-2-[4-[(5-ethanoyl-2-ethoxy-phenyl)methyl]piperazine-1,4-diium-1-yl]ethanamide Openeye Name: 2-[4-[(5-acetyl-2-ethoxy-phenyl)methyl]piperazine-1,4-diium-1-yl]-N-(2,6-dimethylphenyl)acetamide CAS Name: 2-[4-[(5-acetyl-2-ethoxyphenyl)methyl]-1-piperazine-1,4-diiumyl]-N-(2,6-dimethylphenyl)acetamide IUPAC Name: 2-[4-[(5-acetyl-2-ethoxyphenyl)methyl]piperazine-1,4-diium-1-yl]-N-(2,6-dimethylphenyl)acetamide Traditional Name: 2-[4-(5-acetyl-2-ethoxy-benzyl)piperazine-1,4-diium-1-yl]-N-(2,6-dimethylphenyl)acetamide Formula: C25H35N3O3+2 MolecularWeight: 425.5637

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)C)C[NH+]2CC[NH+](CC2)CC(=O)NC3=C(C=CC=C3C)C

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)C)C[NH+]2CC[NH+](CC2)CC(=O)NC3=C(C=CC=C3C)C

InChI

InChI=1S/C25H33N3O3/c1-5-31-23-10-9-21(20(4)29)15-22(23)16-27-11-13-28(14-12-27)17-24(30)26-25-18(2)7-6-8-19(25)3/h6-10,15H,5,11-14,16-17H2,1-4H3,(H,26,30)/p+2