(E)-2-cyano-3-[5-(4-methyl-2-nitro-phenyl)furan-2-yl]-N-(phenylmethyl)prop-2-enamide

Systemtic Name: (E)-2-cyano-3-[5-(4-methyl-2-nitro-phenyl)furan-2-yl]-N-(phenylmethyl)prop-2-enamide Openeye Name: (E)-N-benzyl-2-cyano-3-[5-(4-methyl-2-nitro-phenyl)-2-furyl]prop-2-enamide CAS Name: (E)-2-cyano-3-[5-(4-methyl-2-nitrophenyl)-2-furanyl]-N-(phenylmethyl)-2-propenamide IUPAC Name: (E)-N-benzyl-2-cyano-3-[5-(4-methyl-2-nitrophenyl)furan-2-yl]prop-2-enamide Traditional Name: (E)-N-benzyl-2-cyano-3-[5-(4-methyl-2-nitro-phenyl)-2-furyl]acrylamide Formula: C22H17N3O4 MolecularWeight: 387.38808

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C2=CC=C(O2)C=C(C#N)C(=O)NCC3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)C2=CC=C(O2)/C=C(\C#N)/C(=O)NCC3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C22H17N3O4/c1-15-7-9-19(20(11-15)25(27)28)21-10-8-18(29-21)12-17(13-23)22(26)24-14-16-5-3-2-4-6-16/h2-12H,14H2,1H3,(H,24,26)/b17-12+