(E)-3-[3,5-bis(iodanyl)-2-phenylmethoxy-phenyl]-2-(3-nitrophenyl)carbonyl-prop-2-enenitrile

Systemtic Name: (E)-3-[3,5-bis(iodanyl)-2-phenylmethoxy-phenyl]-2-(3-nitrophenyl)carbonyl-prop-2-enenitrile Openeye Name: (E)-3-(2-benzyloxy-3,5-diiodo-phenyl)-2-(3-nitrobenzoyl)prop-2-enenitrile CAS Name: (E)-3-(3,5-diiodo-2-phenylmethoxyphenyl)-2-[(3-nitrophenyl)-oxomethyl]-2-propenenitrile IUPAC Name: (E)-3-(3,5-diiodo-2-phenylmethoxyphenyl)-2-(3-nitrobenzoyl)prop-2-enenitrile Traditional Name: (E)-3-(2-benzoxy-3,5-diiodo-phenyl)-2-(3-nitrobenzoyl)acrylonitrile Formula: C23H14I2N2O4 MolecularWeight: 636.1772

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=C(C=C(C=C2C=C(C#N)C(=O)C3=CC(=CC=C3)[N+](=O)[O-])I)I

Isomeric SMILES

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

InChI

InChI=1S/C23H14I2N2O4/c24-19-10-17(23(21(25)12-19)31-14-15-5-2-1-3-6-15)9-18(13-26)22(28)16-7-4-8-20(11-16)27(29)30/h1-12H,14H2/b18-9+