N-(2,3-dimethylphenyl)-2-[4-[(2-oxidanylnaphthalen-1-yl)methyl]piperazine-1,4-diium-1-yl]ethanamide

Systemtic Name: N-(2,3-dimethylphenyl)-2-[4-[(2-oxidanylnaphthalen-1-yl)methyl]piperazine-1,4-diium-1-yl]ethanamide Openeye Name: N-(2,3-dimethylphenyl)-2-[4-[(2-hydroxy-1-naphthyl)methyl]piperazine-1,4-diium-1-yl]acetamide CAS Name: N-(2,3-dimethylphenyl)-2-[4-[(2-hydroxy-1-naphthalenyl)methyl]-1-piperazine-1,4-diiumyl]acetamide IUPAC Name: N-(2,3-dimethylphenyl)-2-[4-[(2-hydroxynaphthalen-1-yl)methyl]piperazine-1,4-diium-1-yl]acetamide Traditional Name: N-(2,3-dimethylphenyl)-2-[4-[(2-hydroxy-1-naphthyl)methyl]piperazine-1,4-diium-1-yl]acetamide Formula: C25H31N3O2+2 MolecularWeight: 405.53254

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC(=O)C[NH+]2CC[NH+](CC2)CC3=C(C=CC4=CC=CC=C43)O)C

Isomeric SMILES

CC1=C(C(=CC=C1)NC(=O)C[NH+]2CC[NH+](CC2)CC3=C(C=CC4=CC=CC=C43)O)C

InChI

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