1-(1,3-benzodioxol-5-ylmethyl)-4-[(5-methyl-2-phenyl-1H-imidazol-4-yl)methyl]piperazin-1-ium

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-[(5-methyl-2-phenyl-1H-imidazol-4-yl)methyl]piperazin-1-ium Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-[(5-methyl-2-phenyl-1H-imidazol-4-yl)methyl]piperazin-1-ium CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-[(5-methyl-2-phenyl-1H-imidazol-4-yl)methyl]piperazin-1-ium IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-[(5-methyl-2-phenyl-1H-imidazol-4-yl)methyl]piperazin-1-ium Traditional Name: 1-[(5-methyl-2-phenyl-1H-imidazol-4-yl)methyl]-4-piperonyl-piperazin-4-ium Formula: C23H27N4O2+ MolecularWeight: 391.48608

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(N1)C2=CC=CC=C2)CN3CC[NH+](CC3)CC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC1=C(N=C(N1)C2=CC=CC=C2)CN3CC[NH+](CC3)CC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C23H26N4O2/c1-17-20(25-23(24-17)19-5-3-2-4-6-19)15-27-11-9-26(10-12-27)14-18-7-8-21-22(13-18)29-16-28-21/h2-8,13H,9-12,14-16H2,1H3,(H,24,25)/p+1