1-[2-[2-(3-chloranyl-2-oxidanyl-propoxy)phenyl]-2H-1,3-benzothiazol-3-yl]ethanone

Systemtic Name: 1-[2-[2-(3-chloranyl-2-oxidanyl-propoxy)phenyl]-2H-1,3-benzothiazol-3-yl]ethanone Openeye Name: 1-[2-[2-(3-chloro-2-hydroxy-propoxy)phenyl]-2H-1,3-benzothiazol-3-yl]ethanone CAS Name: 1-[2-[2-(3-chloro-2-hydroxypropoxy)phenyl]-2H-1,3-benzothiazol-3-yl]ethanone IUPAC Name: 1-[2-[2-(3-chloro-2-hydroxypropoxy)phenyl]-2H-1,3-benzothiazol-3-yl]ethanone Traditional Name: 1-[2-[2-(3-chloro-2-hydroxy-propoxy)phenyl]-2H-1,3-benzothiazol-3-yl]ethanone Formula: C18H18ClNO3S MolecularWeight: 363.85842

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C(SC2=CC=CC=C21)C3=CC=CC=C3OCC(CCl)O

Isomeric SMILES

CC(=O)N1C(SC2=CC=CC=C21)C3=CC=CC=C3OCC(CCl)O

InChI

InChI=1S/C18H18ClNO3S/c1-12(21)20-15-7-3-5-9-17(15)24-18(20)14-6-2-4-8-16(14)23-11-13(22)10-19/h2-9,13,18,22H,10-11H2,1H3