3-[3-[4-(phenylmethyl)piperazin-1-ium-1-yl]propyl]-1H-indole

Systemtic Name: 3-[3-[4-(phenylmethyl)piperazin-1-ium-1-yl]propyl]-1H-indole Openeye Name: 3-[3-(4-benzylpiperazin-1-ium-1-yl)propyl]-1H-indole CAS Name: 3-[3-[4-(phenylmethyl)-1-piperazin-1-iumyl]propyl]-1H-indole IUPAC Name: 3-[3-(4-benzylpiperazin-1-ium-1-yl)propyl]-1H-indole Traditional Name: 3-[3-(4-benzylpiperazin-1-ium-1-yl)propyl]-1H-indole Formula: C22H28N3+ MolecularWeight: 334.47782

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCCC2=CNC3=CC=CC=C32)CC4=CC=CC=C4

Isomeric SMILES

C1CN(CC[NH+]1CCCC2=CNC3=CC=CC=C32)CC4=CC=CC=C4

InChI

InChI=1S/C22H27N3/c1-2-7-19(8-3-1)18-25-15-13-24(14-16-25)12-6-9-20-17-23-22-11-5-4-10-21(20)22/h1-5,7-8,10-11,17,23H,6,9,12-16,18H2/p+1