1-[5-methoxy-2-methyl-1-(phenylmethyl)indol-3-yl]-2-(4-methylpiperazin-1-ium-1-yl)ethanone

Systemtic Name: 1-[5-methoxy-2-methyl-1-(phenylmethyl)indol-3-yl]-2-(4-methylpiperazin-1-ium-1-yl)ethanone Openeye Name: 1-(1-benzyl-5-methoxy-2-methyl-indol-3-yl)-2-(4-methylpiperazin-1-ium-1-yl)ethanone CAS Name: 1-[5-methoxy-2-methyl-1-(phenylmethyl)-3-indolyl]-2-(4-methyl-1-piperazin-1-iumyl)ethanone IUPAC Name: 1-(1-benzyl-5-methoxy-2-methylindol-3-yl)-2-(4-methylpiperazin-1-ium-1-yl)ethanone Traditional Name: 1-(1-benzyl-5-methoxy-2-methyl-indol-3-yl)-2-(4-methylpiperazin-1-ium-1-yl)ethanone Formula: C24H30N3O2+ MolecularWeight: 392.5139

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1CC3=CC=CC=C3)C=CC(=C2)OC)C(=O)C[NH+]4CCN(CC4)C

Isomeric SMILES

CC1=C(C2=C(N1CC3=CC=CC=C3)C=CC(=C2)OC)C(=O)C[NH+]4CCN(CC4)C

InChI

InChI=1S/C24H29N3O2/c1-18-24(23(28)17-26-13-11-25(2)12-14-26)21-15-20(29-3)9-10-22(21)27(18)16-19-7-5-4-6-8-19/h4-10,15H,11-14,16-17H2,1-3H3/p+1