1-(2,6-dimethyl-1H-indol-3-yl)-2-(4-phenylpiperazin-1-ium-1-yl)ethanone

Systemtic Name: 1-(2,6-dimethyl-1H-indol-3-yl)-2-(4-phenylpiperazin-1-ium-1-yl)ethanone Openeye Name: 1-(2,6-dimethyl-1H-indol-3-yl)-2-(4-phenylpiperazin-1-ium-1-yl)ethanone CAS Name: 1-(2,6-dimethyl-1H-indol-3-yl)-2-(4-phenyl-1-piperazin-1-iumyl)ethanone IUPAC Name: 1-(2,6-dimethyl-1H-indol-3-yl)-2-(4-phenylpiperazin-1-ium-1-yl)ethanone Traditional Name: 1-(2,6-dimethyl-1H-indol-3-yl)-2-(4-phenylpiperazin-1-ium-1-yl)ethanone Formula: C22H26N3O+ MolecularWeight: 348.46134

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=C(N2)C)C(=O)C[NH+]3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC2=C(C=C1)C(=C(N2)C)C(=O)C[NH+]3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C22H25N3O/c1-16-8-9-19-20(14-16)23-17(2)22(19)21(26)15-24-10-12-25(13-11-24)18-6-4-3-5-7-18/h3-9,14,23H,10-13,15H2,1-2H3/p+1