(E)-3-[5-(4-methyl-3-nitro-phenyl)furan-2-yl]-2-(phenylcarbonyl)prop-2-enenitrile

Systemtic Name: (E)-3-[5-(4-methyl-3-nitro-phenyl)furan-2-yl]-2-(phenylcarbonyl)prop-2-enenitrile Openeye Name: (E)-2-benzoyl-3-[5-(4-methyl-3-nitro-phenyl)-2-furyl]prop-2-enenitrile CAS Name: (E)-2-benzoyl-3-[5-(4-methyl-3-nitrophenyl)-2-furanyl]-2-propenenitrile IUPAC Name: (E)-2-benzoyl-3-[5-(4-methyl-3-nitrophenyl)furan-2-yl]prop-2-enenitrile Traditional Name: (E)-2-benzoyl-3-[5-(4-methyl-3-nitro-phenyl)-2-furyl]acrylonitrile Formula: C21H14N2O4 MolecularWeight: 358.34686

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H14N2O4/c1-14-7-8-16(12-19(14)23(25)26)20-10-9-18(27-20)11-17(13-22)21(24)15-5-3-2-4-6-15/h2-12H,1H3/b17-11+