(E)-3-(2-chloranyl-6-fluoranyl-phenyl)-N-(6-nitro-1,3-benzothiazol-2-yl)prop-2-enamide

Systemtic Name: (E)-3-(2-chloranyl-6-fluoranyl-phenyl)-N-(6-nitro-1,3-benzothiazol-2-yl)prop-2-enamide Openeye Name: (E)-3-(2-chloro-6-fluoro-phenyl)-N-(6-nitro-1,3-benzothiazol-2-yl)prop-2-enamide CAS Name: (E)-3-(2-chloro-6-fluorophenyl)-N-(6-nitro-1,3-benzothiazol-2-yl)-2-propenamide IUPAC Name: (E)-3-(2-chloro-6-fluorophenyl)-N-(6-nitro-1,3-benzothiazol-2-yl)prop-2-enamide Traditional Name: (E)-3-(2-chloro-6-fluoro-phenyl)-N-(6-nitro-1,3-benzothiazol-2-yl)acrylamide Formula: C16H9ClFN3O3S MolecularWeight: 377.777363

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)Cl)C=CC(=O)NC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-])F

Isomeric SMILES

C1=CC(=C(C(=C1)Cl)/C=C/C(=O)NC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-])F

InChI

InChI=1S/C16H9ClFN3O3S/c17-11-2-1-3-12(18)10(11)5-7-15(22)20-16-19-13-6-4-9(21(23)24)8-14(13)25-16/h1-8H,(H,19,20,22)/b7-5+