2-[4-(1,3-benzothiazol-2-yl)piperidin-1-ium-1-yl]-N-(3,4-dichlorophenyl)ethanamide

Systemtic Name: 2-[4-(1,3-benzothiazol-2-yl)piperidin-1-ium-1-yl]-N-(3,4-dichlorophenyl)ethanamide Openeye Name: 2-[4-(1,3-benzothiazol-2-yl)piperidin-1-ium-1-yl]-N-(3,4-dichlorophenyl)acetamide CAS Name: 2-[4-(1,3-benzothiazol-2-yl)-1-piperidin-1-iumyl]-N-(3,4-dichlorophenyl)acetamide IUPAC Name: 2-[4-(1,3-benzothiazol-2-yl)piperidin-1-ium-1-yl]-N-(3,4-dichlorophenyl)acetamide Traditional Name: 2-[4-(1,3-benzothiazol-2-yl)piperidin-1-ium-1-yl]-N-(3,4-dichlorophenyl)acetamide Formula: C20H20Cl2N3OS+ MolecularWeight: 421.3633

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C2=NC3=CC=CC=C3S2)CC(=O)NC4=CC(=C(C=C4)Cl)Cl

Isomeric SMILES

C1C[NH+](CCC1C2=NC3=CC=CC=C3S2)CC(=O)NC4=CC(=C(C=C4)Cl)Cl

InChI

InChI=1S/C20H19Cl2N3OS/c21-15-6-5-14(11-16(15)22)23-19(26)12-25-9-7-13(8-10-25)20-24-17-3-1-2-4-18(17)27-20/h1-6,11,13H,7-10,12H2,(H,23,26)/p+1