(E)-N-(2-chloranyl-5-nitro-phenyl)-2-cyano-3-(4-phenylmethoxyphenyl)prop-2-enamide

Systemtic Name: (E)-N-(2-chloranyl-5-nitro-phenyl)-2-cyano-3-(4-phenylmethoxyphenyl)prop-2-enamide Openeye Name: (E)-3-(4-benzyloxyphenyl)-N-(2-chloro-5-nitro-phenyl)-2-cyano-prop-2-enamide CAS Name: (E)-N-(2-chloro-5-nitrophenyl)-2-cyano-3-(4-phenylmethoxyphenyl)-2-propenamide IUPAC Name: (E)-N-(2-chloro-5-nitrophenyl)-2-cyano-3-(4-phenylmethoxyphenyl)prop-2-enamide Traditional Name: (E)-3-(4-benzoxyphenyl)-N-(2-chloro-5-nitro-phenyl)-2-cyano-acrylamide Formula: C23H16ClN3O4 MolecularWeight: 433.84384

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=C(C=C2)C=C(C#N)C(=O)NC3=C(C=CC(=C3)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=C(C=C2)/C=C(\C#N)/C(=O)NC3=C(C=CC(=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C23H16ClN3O4/c24-21-11-8-19(27(29)30)13-22(21)26-23(28)18(14-25)12-16-6-9-20(10-7-16)31-15-17-4-2-1-3-5-17/h1-13H,15H2,(H,26,28)/b18-12+