N-(2,6-dimethylphenyl)-2-[4-[(2-ethoxyphenyl)methyl]piperazine-1,4-diium-1-yl]ethanamide

Systemtic Name: N-(2,6-dimethylphenyl)-2-[4-[(2-ethoxyphenyl)methyl]piperazine-1,4-diium-1-yl]ethanamide Openeye Name: N-(2,6-dimethylphenyl)-2-[4-[(2-ethoxyphenyl)methyl]piperazine-1,4-diium-1-yl]acetamide CAS Name: N-(2,6-dimethylphenyl)-2-[4-[(2-ethoxyphenyl)methyl]-1-piperazine-1,4-diiumyl]acetamide IUPAC Name: N-(2,6-dimethylphenyl)-2-[4-[(2-ethoxyphenyl)methyl]piperazine-1,4-diium-1-yl]acetamide Traditional Name: N-(2,6-dimethylphenyl)-2-[4-(2-ethoxybenzyl)piperazine-1,4-diium-1-yl]acetamide Formula: C23H33N3O2+2 MolecularWeight: 383.52702

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1C[NH+]2CC[NH+](CC2)CC(=O)NC3=C(C=CC=C3C)C

Isomeric SMILES

CCOC1=CC=CC=C1C[NH+]2CC[NH+](CC2)CC(=O)NC3=C(C=CC=C3C)C

InChI

InChI=1S/C23H31N3O2/c1-4-28-21-11-6-5-10-20(21)16-25-12-14-26(15-13-25)17-22(27)24-23-18(2)8-7-9-19(23)3/h5-11H,4,12-17H2,1-3H3,(H,24,27)/p+2