4,5-bis(bromanyl)-N-[1-[(4-chlorophenyl)methyl]piperidin-1-ium-4-yl]thiophene-2-carboxamide

Systemtic Name: 4,5-bis(bromanyl)-N-[1-[(4-chlorophenyl)methyl]piperidin-1-ium-4-yl]thiophene-2-carboxamide Openeye Name: 4,5-dibromo-N-[1-[(4-chlorophenyl)methyl]piperidin-1-ium-4-yl]thiophene-2-carboxamide CAS Name: 4,5-dibromo-N-[1-[(4-chlorophenyl)methyl]-4-piperidin-1-iumyl]-2-thiophenecarboxamide IUPAC Name: 4,5-dibromo-N-[1-[(4-chlorophenyl)methyl]piperidin-1-ium-4-yl]thiophene-2-carboxamide Traditional Name: 4,5-dibromo-N-[1-(4-chlorobenzyl)piperidin-1-ium-4-yl]thiophene-2-carboxamide Formula: C17H18Br2ClN2OS+ MolecularWeight: 493.66362

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1NC(=O)C2=CC(=C(S2)Br)Br)CC3=CC=C(C=C3)Cl

Isomeric SMILES

C1C[NH+](CCC1NC(=O)C2=CC(=C(S2)Br)Br)CC3=CC=C(C=C3)Cl

InChI

InChI=1S/C17H17Br2ClN2OS/c18-14-9-15(24-16(14)19)17(23)21-13-5-7-22(8-6-13)10-11-1-3-12(20)4-2-11/h1-4,9,13H,5-8,10H2,(H,21,23)/p+1