4,5-bis(bromanyl)-N-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]-1H-pyrrole-2-carboxamide

Systemtic Name: 4,5-bis(bromanyl)-N-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]-1H-pyrrole-2-carboxamide Openeye Name: 4,5-dibromo-N-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]-1H-pyrrole-2-carboxamide CAS Name: 4,5-dibromo-N-[3-[(2S)-2-methyl-1-piperidin-1-iumyl]propyl]-1H-pyrrole-2-carboxamide IUPAC Name: 4,5-dibromo-N-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]-1H-pyrrole-2-carboxamide Traditional Name: 4,5-dibromo-N-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]-1H-pyrrole-2-carboxamide Formula: C14H22Br2N3O+ MolecularWeight: 408.15198

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC[NH+]1CCCNC(=O)C2=CC(=C(N2)Br)Br

Isomeric SMILES

C[C@H]1CCCC[NH+]1CCCNC(=O)C2=CC(=C(N2)Br)Br

InChI

InChI=1S/C14H21Br2N3O/c1-10-5-2-3-7-19(10)8-4-6-17-14(20)12-9-11(15)13(16)18-12/h9-10,18H,2-8H2,1H3,(H,17,20)/p+1/t10-/m0/s1