(2R)-N-(1,3-benzothiazol-2-yl)-2-piperidin-1-ium-1-yl-propanamide

Systemtic Name: (2R)-N-(1,3-benzothiazol-2-yl)-2-piperidin-1-ium-1-yl-propanamide Openeye Name: (2R)-N-(1,3-benzothiazol-2-yl)-2-piperidin-1-ium-1-yl-propanamide CAS Name: (2R)-N-(1,3-benzothiazol-2-yl)-2-(1-piperidin-1-iumyl)propanamide IUPAC Name: (2R)-N-(1,3-benzothiazol-2-yl)-2-piperidin-1-ium-1-ylpropanamide Traditional Name: (2R)-N-(1,3-benzothiazol-2-yl)-2-piperidin-1-ium-1-yl-propionamide Formula: C15H20N3OS+ MolecularWeight: 290.4038

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=NC2=CC=CC=C2S1)[NH+]3CCCCC3

Isomeric SMILES

C[C@H](C(=O)NC1=NC2=CC=CC=C2S1)[NH+]3CCCCC3

InChI

InChI=1S/C15H19N3OS/c1-11(18-9-5-2-6-10-18)14(19)17-15-16-12-7-3-4-8-13(12)20-15/h3-4,7-8,11H,2,5-6,9-10H2,1H3,(H,16,17,19)/p+1/t11-/m1/s1