1-[(3-ethyl-2H-1,3-benzothiazol-3-ium-3-yl)methyl]pyrrolidin-2-one

Systemtic Name: 1-[(3-ethyl-2H-1,3-benzothiazol-3-ium-3-yl)methyl]pyrrolidin-2-one Openeye Name: 1-[(3-ethyl-2H-1,3-benzothiazol-3-ium-3-yl)methyl]pyrrolidin-2-one CAS Name: 1-[(3-ethyl-2H-1,3-benzothiazol-3-ium-3-yl)methyl]-2-pyrrolidinone IUPAC Name: 1-[(3-ethyl-2H-1,3-benzothiazol-3-ium-3-yl)methyl]pyrrolidin-2-one Traditional Name: 1-[(3-ethyl-2H-1,3-benzothiazol-3-ium-3-yl)methyl]-2-pyrrolidone Formula: C14H19N2OS+ MolecularWeight: 263.37846

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1(CSC2=CC=CC=C21)CN3CCCC3=O

Isomeric SMILES

CC[N+]1(CSC2=CC=CC=C21)CN3CCCC3=O

InChI

InChI=1S/C14H19N2OS/c1-2-16(10-15-9-5-8-14(15)17)11-18-13-7-4-3-6-12(13)16/h3-4,6-7H,2,5,8-11H2,1H3/q+1