1-[1-(2-methoxyethyl)-2,5-dimethyl-pyrrol-3-yl]-2-[4-(2-methylphenyl)piperazin-1-ium-1-yl]ethanone

Systemtic Name: 1-[1-(2-methoxyethyl)-2,5-dimethyl-pyrrol-3-yl]-2-[4-(2-methylphenyl)piperazin-1-ium-1-yl]ethanone Openeye Name: 1-[1-(2-methoxyethyl)-2,5-dimethyl-pyrrol-3-yl]-2-[4-(o-tolyl)piperazin-1-ium-1-yl]ethanone CAS Name: 1-[1-(2-methoxyethyl)-2,5-dimethyl-3-pyrrolyl]-2-[4-(2-methylphenyl)-1-piperazin-1-iumyl]ethanone IUPAC Name: 1-[1-(2-methoxyethyl)-2,5-dimethylpyrrol-3-yl]-2-[4-(2-methylphenyl)piperazin-1-ium-1-yl]ethanone Traditional Name: 1-[1-(2-methoxyethyl)-2,5-dimethyl-pyrrol-3-yl]-2-[4-(o-tolyl)piperazin-1-ium-1-yl]ethanone Formula: C22H32N3O2+ MolecularWeight: 370.50838

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2CC[NH+](CC2)CC(=O)C3=C(N(C(=C3)C)CCOC)C

Isomeric SMILES

CC1=CC=CC=C1N2CC[NH+](CC2)CC(=O)C3=C(N(C(=C3)C)CCOC)C

InChI

InChI=1S/C22H31N3O2/c1-17-7-5-6-8-21(17)24-11-9-23(10-12-24)16-22(26)20-15-18(2)25(19(20)3)13-14-27-4/h5-8,15H,9-14,16H2,1-4H3/p+1