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

Systemtic Name: 4,5-bis(bromanyl)-N-[1-(phenylmethyl)piperidin-1-ium-4-yl]thiophene-2-carboxamide Openeye Name: N-(1-benzylpiperidin-1-ium-4-yl)-4,5-dibromo-thiophene-2-carboxamide CAS Name: 4,5-dibromo-N-[1-(phenylmethyl)-4-piperidin-1-iumyl]-2-thiophenecarboxamide IUPAC Name: N-(1-benzylpiperidin-1-ium-4-yl)-4,5-dibromothiophene-2-carboxamide Traditional Name: N-(1-benzylpiperidin-1-ium-4-yl)-4,5-dibromo-thiophene-2-carboxamide Formula: C17H19Br2N2OS+ MolecularWeight: 459.21856

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H18Br2N2OS/c18-14-10-15(23-16(14)19)17(22)20-13-6-8-21(9-7-13)11-12-4-2-1-3-5-12/h1-5,10,13H,6-9,11H2,(H,20,22)/p+1