(E)-3-(3,4-dichlorophenyl)-N-(6-nitro-1,3-benzothiazol-2-yl)prop-2-enamide

Systemtic Name: (E)-3-(3,4-dichlorophenyl)-N-(6-nitro-1,3-benzothiazol-2-yl)prop-2-enamide Openeye Name: (E)-3-(3,4-dichlorophenyl)-N-(6-nitro-1,3-benzothiazol-2-yl)prop-2-enamide CAS Name: (E)-3-(3,4-dichlorophenyl)-N-(6-nitro-1,3-benzothiazol-2-yl)-2-propenamide IUPAC Name: (E)-3-(3,4-dichlorophenyl)-N-(6-nitro-1,3-benzothiazol-2-yl)prop-2-enamide Traditional Name: (E)-3-(3,4-dichlorophenyl)-N-(6-nitro-1,3-benzothiazol-2-yl)acrylamide Formula: C16H9Cl2N3O3S MolecularWeight: 394.23196

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C=CC(=O)NC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-])Cl)Cl

Isomeric SMILES

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

InChI

InChI=1S/C16H9Cl2N3O3S/c17-11-4-1-9(7-12(11)18)2-6-15(22)20-16-19-13-5-3-10(21(23)24)8-14(13)25-16/h1-8H,(H,19,20,22)/b6-2+