2-[4-[2-chloranyl-5-(2,5-dimethylpyrrol-1-yl)phenyl]carbonylpiperazin-1-ium-1-yl]-1-piperidin-1-yl-ethanone

Systemtic Name: 2-[4-[2-chloranyl-5-(2,5-dimethylpyrrol-1-yl)phenyl]carbonylpiperazin-1-ium-1-yl]-1-piperidin-1-yl-ethanone Openeye Name: 2-[4-[2-chloro-5-(2,5-dimethylpyrrol-1-yl)benzoyl]piperazin-1-ium-1-yl]-1-(1-piperidyl)ethanone CAS Name: 2-[4-[[2-chloro-5-(2,5-dimethyl-1-pyrrolyl)phenyl]-oxomethyl]-1-piperazin-1-iumyl]-1-(1-piperidinyl)ethanone IUPAC Name: 2-[4-[2-chloro-5-(2,5-dimethylpyrrol-1-yl)benzoyl]piperazin-1-ium-1-yl]-1-piperidin-1-ylethanone Traditional Name: 2-[4-[2-chloro-5-(2,5-dimethylpyrrol-1-yl)benzoyl]piperazin-1-ium-1-yl]-1-piperidino-ethanone Formula: C24H32ClN4O2+ MolecularWeight: 443.98948

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(N1C2=CC(=C(C=C2)Cl)C(=O)N3CC[NH+](CC3)CC(=O)N4CCCCC4)C

Isomeric SMILES

CC1=CC=C(N1C2=CC(=C(C=C2)Cl)C(=O)N3CC[NH+](CC3)CC(=O)N4CCCCC4)C

InChI

InChI=1S/C24H31ClN4O2/c1-18-6-7-19(2)29(18)20-8-9-22(25)21(16-20)24(31)28-14-12-26(13-15-28)17-23(30)27-10-4-3-5-11-27/h6-9,16H,3-5,10-15,17H2,1-2H3/p+1