3-[3-[4-[bis(4-methylphenyl)methyl]piperazin-1-ium-1-yl]propyl]-1H-indole

Systemtic Name: 3-[3-[4-[bis(4-methylphenyl)methyl]piperazin-1-ium-1-yl]propyl]-1H-indole Openeye Name: 3-[3-[4-(bis-p-tolylmethyl)piperazin-1-ium-1-yl]propyl]-1H-indole CAS Name: 3-[3-[4-[bis(4-methylphenyl)methyl]-1-piperazin-1-iumyl]propyl]-1H-indole IUPAC Name: 3-[3-[4-[bis(4-methylphenyl)methyl]piperazin-1-ium-1-yl]propyl]-1H-indole Traditional Name: 3-[3-[4-(bis-p-tolylmethyl)piperazin-1-ium-1-yl]propyl]-1H-indole Formula: C30H36N3+ MolecularWeight: 438.62694

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C2=CC=C(C=C2)C)N3CC[NH+](CC3)CCCC4=CNC5=CC=CC=C54

Isomeric SMILES

CC1=CC=C(C=C1)C(C2=CC=C(C=C2)C)N3CC[NH+](CC3)CCCC4=CNC5=CC=CC=C54

InChI

InChI=1S/C30H35N3/c1-23-9-13-25(14-10-23)30(26-15-11-24(2)12-16-26)33-20-18-32(19-21-33)17-5-6-27-22-31-29-8-4-3-7-28(27)29/h3-4,7-16,22,30-31H,5-6,17-21H2,1-2H3/p+1