N-(2-ethylphenyl)-2-[4-[(2-oxidanylnaphthalen-1-yl)methyl]piperazine-1,4-diium-1-yl]ethanamide

Systemtic Name: N-(2-ethylphenyl)-2-[4-[(2-oxidanylnaphthalen-1-yl)methyl]piperazine-1,4-diium-1-yl]ethanamide Openeye Name: N-(2-ethylphenyl)-2-[4-[(2-hydroxy-1-naphthyl)methyl]piperazine-1,4-diium-1-yl]acetamide CAS Name: N-(2-ethylphenyl)-2-[4-[(2-hydroxy-1-naphthalenyl)methyl]-1-piperazine-1,4-diiumyl]acetamide IUPAC Name: N-(2-ethylphenyl)-2-[4-[(2-hydroxynaphthalen-1-yl)methyl]piperazine-1,4-diium-1-yl]acetamide Traditional Name: N-(2-ethylphenyl)-2-[4-[(2-hydroxy-1-naphthyl)methyl]piperazine-1,4-diium-1-yl]acetamide Formula: C25H31N3O2+2 MolecularWeight: 405.53254

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H29N3O2/c1-2-19-7-4-6-10-23(19)26-25(30)18-28-15-13-27(14-16-28)17-22-21-9-5-3-8-20(21)11-12-24(22)29/h3-12,29H,2,13-18H2,1H3,(H,26,30)/p+2