N-(4-butoxyphenyl)-2-[4-(2,5-dimethylphenyl)piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-(4-butoxyphenyl)-2-[4-(2,5-dimethylphenyl)piperazin-1-ium-1-yl]ethanamide Openeye Name: N-(4-butoxyphenyl)-2-[4-(2,5-dimethylphenyl)piperazin-1-ium-1-yl]acetamide CAS Name: N-(4-butoxyphenyl)-2-[4-(2,5-dimethylphenyl)-1-piperazin-1-iumyl]acetamide IUPAC Name: N-(4-butoxyphenyl)-2-[4-(2,5-dimethylphenyl)piperazin-1-ium-1-yl]acetamide Traditional Name: N-(4-butoxyphenyl)-2-[4-(2,5-dimethylphenyl)piperazin-1-ium-1-yl]acetamide Formula: C24H34N3O2+ MolecularWeight: 396.54566

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)NC(=O)C[NH+]2CCN(CC2)C3=C(C=CC(=C3)C)C

Isomeric SMILES

CCCCOC1=CC=C(C=C1)NC(=O)C[NH+]2CCN(CC2)C3=C(C=CC(=C3)C)C

InChI

InChI=1S/C24H33N3O2/c1-4-5-16-29-22-10-8-21(9-11-22)25-24(28)18-26-12-14-27(15-13-26)23-17-19(2)6-7-20(23)3/h6-11,17H,4-5,12-16,18H2,1-3H3,(H,25,28)/p+1