3-[[4-[(2,3-dimethoxyphenyl)methyl]piperazin-1-ium-1-yl]methyl]-1H-indole

Systemtic Name: 3-[[4-[(2,3-dimethoxyphenyl)methyl]piperazin-1-ium-1-yl]methyl]-1H-indole Openeye Name: 3-[[4-[(2,3-dimethoxyphenyl)methyl]piperazin-1-ium-1-yl]methyl]-1H-indole CAS Name: 3-[[4-[(2,3-dimethoxyphenyl)methyl]-1-piperazin-1-iumyl]methyl]-1H-indole IUPAC Name: 3-[[4-[(2,3-dimethoxyphenyl)methyl]piperazin-1-ium-1-yl]methyl]-1H-indole Traditional Name: 3-[(4-o-veratrylpiperazin-1-ium-1-yl)methyl]-1H-indole Formula: C22H28N3O2+ MolecularWeight: 366.47662

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OC)CN2CC[NH+](CC2)CC3=CNC4=CC=CC=C43

Isomeric SMILES

COC1=CC=CC(=C1OC)CN2CC[NH+](CC2)CC3=CNC4=CC=CC=C43

InChI

InChI=1S/C22H27N3O2/c1-26-21-9-5-6-17(22(21)27-2)15-24-10-12-25(13-11-24)16-18-14-23-20-8-4-3-7-19(18)20/h3-9,14,23H,10-13,15-16H2,1-2H3/p+1