2-[1-(phenylmethyl)piperidin-1-ium-4-yl]-1,3-benzothiazole

Systemtic Name: 2-[1-(phenylmethyl)piperidin-1-ium-4-yl]-1,3-benzothiazole Openeye Name: 2-(1-benzylpiperidin-1-ium-4-yl)-1,3-benzothiazole CAS Name: 2-[1-(phenylmethyl)-4-piperidin-1-iumyl]-1,3-benzothiazole IUPAC Name: 2-(1-benzylpiperidin-1-ium-4-yl)-1,3-benzothiazole Traditional Name: 2-(1-benzylpiperidin-1-ium-4-yl)-1,3-benzothiazole Formula: C19H21N2S+ MolecularWeight: 309.44844

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C2=NC3=CC=CC=C3S2)CC4=CC=CC=C4

Isomeric SMILES

C1C[NH+](CCC1C2=NC3=CC=CC=C3S2)CC4=CC=CC=C4

InChI

InChI=1S/C19H20N2S/c1-2-6-15(7-3-1)14-21-12-10-16(11-13-21)19-20-17-8-4-5-9-18(17)22-19/h1-9,16H,10-14H2/p+1