1-[4-[2-(2,5-dimethylpyrrol-1-yl)ethyl]piperazin-4-ium-1-yl]-2,2-dimethyl-propan-1-one

Systemtic Name: 1-[4-[2-(2,5-dimethylpyrrol-1-yl)ethyl]piperazin-4-ium-1-yl]-2,2-dimethyl-propan-1-one Openeye Name: 1-[4-[2-(2,5-dimethylpyrrol-1-yl)ethyl]piperazin-4-ium-1-yl]-2,2-dimethyl-propan-1-one CAS Name: 1-[4-[2-(2,5-dimethyl-1-pyrrolyl)ethyl]-1-piperazin-4-iumyl]-2,2-dimethyl-1-propanone IUPAC Name: 1-[4-[2-(2,5-dimethylpyrrol-1-yl)ethyl]piperazin-4-ium-1-yl]-2,2-dimethylpropan-1-one Traditional Name: 1-[4-[2-(2,5-dimethylpyrrol-1-yl)ethyl]piperazin-4-ium-1-yl]-2,2-dimethyl-propan-1-one Formula: C17H30N3O+ MolecularWeight: 292.4396

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(N1CC[NH+]2CCN(CC2)C(=O)C(C)(C)C)C

Isomeric SMILES

CC1=CC=C(N1CC[NH+]2CCN(CC2)C(=O)C(C)(C)C)C

InChI

InChI=1S/C17H29N3O/c1-14-6-7-15(2)20(14)13-10-18-8-11-19(12-9-18)16(21)17(3,4)5/h6-7H,8-13H2,1-5H3/p+1