2-[4-[4,5-bis(bromanyl)-1-methyl-pyrrol-2-yl]carbonylpiperazin-1-ium-1-yl]-N-prop-2-enyl-ethanamide

Systemtic Name: 2-[4-[4,5-bis(bromanyl)-1-methyl-pyrrol-2-yl]carbonylpiperazin-1-ium-1-yl]-N-prop-2-enyl-ethanamide Openeye Name: N-allyl-2-[4-(4,5-dibromo-1-methyl-pyrrole-2-carbonyl)piperazin-1-ium-1-yl]acetamide CAS Name: 2-[4-[(4,5-dibromo-1-methyl-2-pyrrolyl)-oxomethyl]-1-piperazin-1-iumyl]-N-prop-2-enylacetamide IUPAC Name: 2-[4-(4,5-dibromo-1-methylpyrrole-2-carbonyl)piperazin-1-ium-1-yl]-N-prop-2-enylacetamide Traditional Name: N-allyl-2-[4-(4,5-dibromo-1-methyl-pyrrole-2-carbonyl)piperazin-1-ium-1-yl]acetamide Formula: C15H21Br2N4O2+ MolecularWeight: 449.16084

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC(=C1Br)Br)C(=O)N2CC[NH+](CC2)CC(=O)NCC=C

Isomeric SMILES

CN1C(=CC(=C1Br)Br)C(=O)N2CC[NH+](CC2)CC(=O)NCC=C

InChI

InChI=1S/C15H20Br2N4O2/c1-3-4-18-13(22)10-20-5-7-21(8-6-20)15(23)12-9-11(16)14(17)19(12)2/h3,9H,1,4-8,10H2,2H3,(H,18,22)/p+1