2-(4-cyclopropylcarbonylpiperazin-1-ium-1-yl)-1-(2,5-dimethyl-1-phenethyl-pyrrol-3-yl)ethanone

Systemtic Name: 2-(4-cyclopropylcarbonylpiperazin-1-ium-1-yl)-1-(2,5-dimethyl-1-phenethyl-pyrrol-3-yl)ethanone Openeye Name: 2-[4-(cyclopropanecarbonyl)piperazin-1-ium-1-yl]-1-(2,5-dimethyl-1-phenethyl-pyrrol-3-yl)ethanone CAS Name: 2-[4-[cyclopropyl(oxo)methyl]-1-piperazin-1-iumyl]-1-(2,5-dimethyl-1-phenethyl-3-pyrrolyl)ethanone IUPAC Name: 2-[4-(cyclopropanecarbonyl)piperazin-1-ium-1-yl]-1-(2,5-dimethyl-1-phenethylpyrrol-3-yl)ethanone Traditional Name: 2-[4-(cyclopropanecarbonyl)piperazin-1-ium-1-yl]-1-(2,5-dimethyl-1-phenethyl-pyrrol-3-yl)ethanone Formula: C24H32N3O2+ MolecularWeight: 394.52978

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CCC2=CC=CC=C2)C)C(=O)C[NH+]3CCN(CC3)C(=O)C4CC4

Isomeric SMILES

CC1=CC(=C(N1CCC2=CC=CC=C2)C)C(=O)C[NH+]3CCN(CC3)C(=O)C4CC4

InChI

InChI=1S/C24H31N3O2/c1-18-16-22(19(2)27(18)11-10-20-6-4-3-5-7-20)23(28)17-25-12-14-26(15-13-25)24(29)21-8-9-21/h3-7,16,21H,8-15,17H2,1-2H3/p+1