N-(2,6-dimethylphenyl)-2-[4-[2-(2-methylindol-1-yl)ethanoyl]piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-(2,6-dimethylphenyl)-2-[4-[2-(2-methylindol-1-yl)ethanoyl]piperazin-1-ium-1-yl]ethanamide Openeye Name: N-(2,6-dimethylphenyl)-2-[4-[2-(2-methylindol-1-yl)acetyl]piperazin-1-ium-1-yl]acetamide CAS Name: N-(2,6-dimethylphenyl)-2-[4-[2-(2-methyl-1-indolyl)-1-oxoethyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-(2,6-dimethylphenyl)-2-[4-[2-(2-methylindol-1-yl)acetyl]piperazin-1-ium-1-yl]acetamide Traditional Name: N-(2,6-dimethylphenyl)-2-[4-[2-(2-methylindol-1-yl)acetyl]piperazin-1-ium-1-yl]acetamide Formula: C25H31N4O2+ MolecularWeight: 419.53924

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)C[NH+]2CCN(CC2)C(=O)CN3C(=CC4=CC=CC=C43)C

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)C[NH+]2CCN(CC2)C(=O)CN3C(=CC4=CC=CC=C43)C

InChI

InChI=1S/C25H30N4O2/c1-18-7-6-8-19(2)25(18)26-23(30)16-27-11-13-28(14-12-27)24(31)17-29-20(3)15-21-9-4-5-10-22(21)29/h4-10,15H,11-14,16-17H2,1-3H3,(H,26,30)/p+1