5,6-dimethoxy-2-methyl-3-[2-(4-phenylpiperazin-1-ium-1-yl)ethyl]-1H-indole chloride

Systemtic Name: 5,6-dimethoxy-2-methyl-3-[2-(4-phenylpiperazin-1-ium-1-yl)ethyl]-1H-indole chloride Openeye Name: 5,6-dimethoxy-2-methyl-3-[2-(4-phenylpiperazin-1-ium-1-yl)ethyl]-1H-indole chloride CAS Name: 5,6-dimethoxy-2-methyl-3-[2-(4-phenyl-1-piperazin-1-iumyl)ethyl]-1H-indole chloride IUPAC Name: 5,6-dimethoxy-2-methyl-3-[2-(4-phenylpiperazin-1-ium-1-yl)ethyl]-1H-indole chloride Traditional Name: 5,6-dimethoxy-2-methyl-3-[2-(4-phenylpiperazin-1-ium-1-yl)ethyl]-1H-indole chloride Formula: C23H30ClN3O2 MolecularWeight: 415.9562

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC(=C(C=C2N1)OC)OC)CC[NH+]3CCN(CC3)C4=CC=CC=C4.[Cl-]

Isomeric SMILES

CC1=C(C2=CC(=C(C=C2N1)OC)OC)CC[NH+]3CCN(CC3)C4=CC=CC=C4.[Cl-]

InChI

InChI=1S/C23H29N3O2.ClH/c1-17-19(20-15-22(27-2)23(28-3)16-21(20)24-17)9-10-25-11-13-26(14-12-25)18-7-5-4-6-8-18;/h4-8,15-16,24H,9-14H2,1-3H3;1H