(E)-3-(3-bromanyl-4-phenylmethoxy-phenyl)-2-(3-nitrophenyl)carbonyl-prop-2-enenitrile

Systemtic Name: (E)-3-(3-bromanyl-4-phenylmethoxy-phenyl)-2-(3-nitrophenyl)carbonyl-prop-2-enenitrile Openeye Name: (E)-3-(4-benzyloxy-3-bromo-phenyl)-2-(3-nitrobenzoyl)prop-2-enenitrile CAS Name: (E)-3-(3-bromo-4-phenylmethoxyphenyl)-2-[(3-nitrophenyl)-oxomethyl]-2-propenenitrile IUPAC Name: (E)-3-(3-bromo-4-phenylmethoxyphenyl)-2-(3-nitrobenzoyl)prop-2-enenitrile Traditional Name: (E)-3-(4-benzoxy-3-bromo-phenyl)-2-(3-nitrobenzoyl)acrylonitrile Formula: C23H15BrN2O4 MolecularWeight: 463.2802

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Descriptors Computed from Structure

Canonical 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-])Br

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-])Br

InChI

InChI=1S/C23H15BrN2O4/c24-21-12-17(9-10-22(21)30-15-16-5-2-1-3-6-16)11-19(14-25)23(27)18-7-4-8-20(13-18)26(28)29/h1-13H,15H2/b19-11+