dimethyl-[2-[4-(3-methylbenzo[g][1]benzofuran-2-yl)carbonylpiperazin-1-ium-1-yl]ethyl]azanium

Systemtic Name: dimethyl-[2-[4-(3-methylbenzo[g][1]benzofuran-2-yl)carbonylpiperazin-1-ium-1-yl]ethyl]azanium Openeye Name: dimethyl-[2-[4-(3-methylbenzo[g]benzofuran-2-carbonyl)piperazin-1-ium-1-yl]ethyl]ammonium CAS Name: dimethyl-[2-[4-[(3-methyl-2-benzo[g]benzofuranyl)-oxomethyl]-1-piperazin-1-iumyl]ethyl]ammonium IUPAC Name: dimethyl-[2-[4-(3-methylbenzo[g][1]benzofuran-2-carbonyl)piperazin-1-ium-1-yl]ethyl]azanium Traditional Name: dimethyl-[2-[4-(3-methylbenzo[g]benzofuran-2-carbonyl)piperazin-1-ium-1-yl]ethyl]ammonium Formula: C22H29N3O2+2 MolecularWeight: 367.48456

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C=CC3=CC=CC=C32)C(=O)N4CC[NH+](CC4)CC[NH+](C)C

Isomeric SMILES

CC1=C(OC2=C1C=CC3=CC=CC=C32)C(=O)N4CC[NH+](CC4)CC[NH+](C)C

InChI

InChI=1S/C22H27N3O2/c1-16-18-9-8-17-6-4-5-7-19(17)21(18)27-20(16)22(26)25-14-12-24(13-15-25)11-10-23(2)3/h4-9H,10-15H2,1-3H3/p+2