2-chloranyl-N-(6-fluoranyl-3-prop-2-enyl-1,3-benzothiazol-2-ylidene)-5-nitro-benzamide

Systemtic Name: 2-chloranyl-N-(6-fluoranyl-3-prop-2-enyl-1,3-benzothiazol-2-ylidene)-5-nitro-benzamide Openeye Name: N-(3-allyl-6-fluoro-1,3-benzothiazol-2-ylidene)-2-chloro-5-nitro-benzamide CAS Name: 2-chloro-N-(6-fluoro-3-prop-2-enyl-1,3-benzothiazol-2-ylidene)-5-nitrobenzamide IUPAC Name: 2-chloro-N-(6-fluoro-3-prop-2-enyl-1,3-benzothiazol-2-ylidene)-5-nitrobenzamide Traditional Name: N-(3-allyl-6-fluoro-1,3-benzothiazol-2-ylidene)-2-chloro-5-nitro-benzamide Formula: C17H11ClFN3O3S MolecularWeight: 391.803943

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C2=C(C=C(C=C2)F)SC1=NC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])Cl

Isomeric SMILES

C=CCN1C2=C(C=C(C=C2)F)SC1=NC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C17H11ClFN3O3S/c1-2-7-21-14-6-3-10(19)8-15(14)26-17(21)20-16(23)12-9-11(22(24)25)4-5-13(12)18/h2-6,8-9H,1,7H2