1-(2,3-dimethylindol-1-yl)-2-[4-(phenylmethyl)piperazine-1,4-diium-1-yl]ethanone

Systemtic Name: 1-(2,3-dimethylindol-1-yl)-2-[4-(phenylmethyl)piperazine-1,4-diium-1-yl]ethanone Openeye Name: 2-(4-benzylpiperazine-1,4-diium-1-yl)-1-(2,3-dimethylindol-1-yl)ethanone CAS Name: 1-(2,3-dimethyl-1-indolyl)-2-[4-(phenylmethyl)-1-piperazine-1,4-diiumyl]ethanone IUPAC Name: 2-(4-benzylpiperazine-1,4-diium-1-yl)-1-(2,3-dimethylindol-1-yl)ethanone Traditional Name: 2-(4-benzylpiperazine-1,4-diium-1-yl)-1-(2,3-dimethylindol-1-yl)ethanone Formula: C23H29N3O+2 MolecularWeight: 363.49586

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C2=CC=CC=C12)C(=O)C[NH+]3CC[NH+](CC3)CC4=CC=CC=C4)C

Isomeric SMILES

CC1=C(N(C2=CC=CC=C12)C(=O)C[NH+]3CC[NH+](CC3)CC4=CC=CC=C4)C

InChI

InChI=1S/C23H27N3O/c1-18-19(2)26(22-11-7-6-10-21(18)22)23(27)17-25-14-12-24(13-15-25)16-20-8-4-3-5-9-20/h3-11H,12-17H2,1-2H3/p+2