2-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]-1-(5-methyl-1H-indol-3-yl)ethanone

Systemtic Name: 2-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]-1-(5-methyl-1H-indol-3-yl)ethanone Openeye Name: 2-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]-1-(5-methyl-1H-indol-3-yl)ethanone CAS Name: 2-[4-(2-methoxyphenyl)-1-piperazin-1-iumyl]-1-(5-methyl-1H-indol-3-yl)ethanone IUPAC Name: 2-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]-1-(5-methyl-1H-indol-3-yl)ethanone Traditional Name: 2-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]-1-(5-methyl-1H-indol-3-yl)ethanone Formula: C22H26N3O2+ MolecularWeight: 364.46074

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)NC=C2C(=O)C[NH+]3CCN(CC3)C4=CC=CC=C4OC

Isomeric SMILES

CC1=CC2=C(C=C1)NC=C2C(=O)C[NH+]3CCN(CC3)C4=CC=CC=C4OC

InChI

InChI=1S/C22H25N3O2/c1-16-7-8-19-17(13-16)18(14-23-19)21(26)15-24-9-11-25(12-10-24)20-5-3-4-6-22(20)27-2/h3-8,13-14,23H,9-12,15H2,1-2H3/p+1