N-(2-ethyl-6-methyl-phenyl)-2-[4-(naphthalen-1-ylmethyl)piperazine-1,4-diium-1-yl]ethanamide

Systemtic Name: N-(2-ethyl-6-methyl-phenyl)-2-[4-(naphthalen-1-ylmethyl)piperazine-1,4-diium-1-yl]ethanamide Openeye Name: N-(2-ethyl-6-methyl-phenyl)-2-[4-(1-naphthylmethyl)piperazine-1,4-diium-1-yl]acetamide CAS Name: N-(2-ethyl-6-methylphenyl)-2-[4-(1-naphthalenylmethyl)-1-piperazine-1,4-diiumyl]acetamide IUPAC Name: N-(2-ethyl-6-methylphenyl)-2-[4-(naphthalen-1-ylmethyl)piperazine-1,4-diium-1-yl]acetamide Traditional Name: N-(2-ethyl-6-methyl-phenyl)-2-[4-(1-naphthylmethyl)piperazine-1,4-diium-1-yl]acetamide Formula: C26H33N3O+2 MolecularWeight: 403.55972

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=O)C[NH+]2CC[NH+](CC2)CC3=CC=CC4=CC=CC=C43)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=O)C[NH+]2CC[NH+](CC2)CC3=CC=CC4=CC=CC=C43)C

InChI

InChI=1S/C26H31N3O/c1-3-21-10-6-8-20(2)26(21)27-25(30)19-29-16-14-28(15-17-29)18-23-12-7-11-22-9-4-5-13-24(22)23/h4-13H,3,14-19H2,1-2H3,(H,27,30)/p+2