2-[4-[2-(4-chloranylphenoxy)ethyl]piperazin-1-ium-1-yl]-1-(2-methyl-1H-indol-3-yl)ethanone

Systemtic Name: 2-[4-[2-(4-chloranylphenoxy)ethyl]piperazin-1-ium-1-yl]-1-(2-methyl-1H-indol-3-yl)ethanone Openeye Name: 2-[4-[2-(4-chlorophenoxy)ethyl]piperazin-1-ium-1-yl]-1-(2-methyl-1H-indol-3-yl)ethanone CAS Name: 2-[4-[2-(4-chlorophenoxy)ethyl]-1-piperazin-1-iumyl]-1-(2-methyl-1H-indol-3-yl)ethanone IUPAC Name: 2-[4-[2-(4-chlorophenoxy)ethyl]piperazin-1-ium-1-yl]-1-(2-methyl-1H-indol-3-yl)ethanone Traditional Name: 2-[4-[2-(4-chlorophenoxy)ethyl]piperazin-1-ium-1-yl]-1-(2-methyl-1H-indol-3-yl)ethanone Formula: C23H27ClN3O2+ MolecularWeight: 412.93238

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N1)C(=O)C[NH+]3CCN(CC3)CCOC4=CC=C(C=C4)Cl

Isomeric SMILES

CC1=C(C2=CC=CC=C2N1)C(=O)C[NH+]3CCN(CC3)CCOC4=CC=C(C=C4)Cl

InChI

InChI=1S/C23H26ClN3O2/c1-17-23(20-4-2-3-5-21(20)25-17)22(28)16-27-12-10-26(11-13-27)14-15-29-19-8-6-18(24)7-9-19/h2-9,25H,10-16H2,1H3/p+1