4-cyano-2-fluoranyl-N-[(E)-[1-(4-methoxy-2-nitro-phenyl)-2,5-dimethyl-pyrrol-3-yl]methylideneamino]benzamide

Systemtic Name: 4-cyano-2-fluoranyl-N-[(E)-[1-(4-methoxy-2-nitro-phenyl)-2,5-dimethyl-pyrrol-3-yl]methylideneamino]benzamide Openeye Name: 4-cyano-2-fluoro-N-[(E)-[1-(4-methoxy-2-nitro-phenyl)-2,5-dimethyl-pyrrol-3-yl]methyleneamino]benzamide CAS Name: 4-cyano-2-fluoro-N-[(E)-[1-(4-methoxy-2-nitrophenyl)-2,5-dimethyl-3-pyrrolyl]methylideneamino]benzamide IUPAC Name: 4-cyano-2-fluoro-N-[(E)-[1-(4-methoxy-2-nitrophenyl)-2,5-dimethylpyrrol-3-yl]methylideneamino]benzamide Traditional Name: 4-cyano-2-fluoro-N-[(E)-[1-(4-methoxy-2-nitro-phenyl)-2,5-dimethyl-pyrrol-3-yl]methyleneamino]benzamide Formula: C22H18FN5O4 MolecularWeight: 435.407823

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=C(C=C(C=C2)OC)[N+](=O)[O-])C)C=NNC(=O)C3=C(C=C(C=C3)C#N)F

Isomeric SMILES

CC1=CC(=C(N1C2=C(C=C(C=C2)OC)[N+](=O)[O-])C)/C=N/NC(=O)C3=C(C=C(C=C3)C#N)F

InChI

InChI=1S/C22H18FN5O4/c1-13-8-16(12-25-26-22(29)18-6-4-15(11-24)9-19(18)23)14(2)27(13)20-7-5-17(32-3)10-21(20)28(30)31/h4-10,12H,1-3H3,(H,26,29)/b25-12+