(1,5-dimethylpyrrol-2-yl)-piperazin-4-ium-1-yl-methanone

Systemtic Name: (1,5-dimethylpyrrol-2-yl)-piperazin-4-ium-1-yl-methanone Openeye Name: (1,5-dimethylpyrrol-2-yl)-piperazin-4-ium-1-yl-methanone CAS Name: (1,5-dimethyl-2-pyrrolyl)-(1-piperazin-4-iumyl)methanone IUPAC Name: (1,5-dimethylpyrrol-2-yl)-piperazin-4-ium-1-ylmethanone Traditional Name: (1,5-dimethylpyrrol-2-yl)-piperazin-4-ium-1-yl-methanone Formula: C11H18N3O+ MolecularWeight: 208.28012

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(N1C)C(=O)N2CC[NH2+]CC2

Isomeric SMILES

CC1=CC=C(N1C)C(=O)N2CC[NH2+]CC2

InChI

InChI=1S/C11H17N3O/c1-9-3-4-10(13(9)2)11(15)14-7-5-12-6-8-14/h3-4,12H,5-8H2,1-2H3/p+1