3,6-bis(chloranyl)-N-(1-propylpiperidin-1-ium-4-yl)-1-benzothiophene-2-carboxamide

Systemtic Name: 3,6-bis(chloranyl)-N-(1-propylpiperidin-1-ium-4-yl)-1-benzothiophene-2-carboxamide Openeye Name: 3,6-dichloro-N-(1-propylpiperidin-1-ium-4-yl)benzothiophene-2-carboxamide CAS Name: 3,6-dichloro-N-(1-propyl-4-piperidin-1-iumyl)-1-benzothiophene-2-carboxamide IUPAC Name: 3,6-dichloro-N-(1-propylpiperidin-1-ium-4-yl)-1-benzothiophene-2-carboxamide Traditional Name: 3,6-dichloro-N-(1-propylpiperidin-1-ium-4-yl)benzothiophene-2-carboxamide Formula: C17H21Cl2N2OS+ MolecularWeight: 372.33244

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+]1CCC(CC1)NC(=O)C2=C(C3=C(S2)C=C(C=C3)Cl)Cl

Isomeric SMILES

CCC[NH+]1CCC(CC1)NC(=O)C2=C(C3=C(S2)C=C(C=C3)Cl)Cl

InChI

InChI=1S/C17H20Cl2N2OS/c1-2-7-21-8-5-12(6-9-21)20-17(22)16-15(19)13-4-3-11(18)10-14(13)23-16/h3-4,10,12H,2,5-9H2,1H3,(H,20,22)/p+1