(E)-3-[5-bromanyl-2-[(4-nitrophenyl)methoxy]phenyl]-2-(phenylcarbonyl)prop-2-enenitrile

Systemtic Name: (E)-3-[5-bromanyl-2-[(4-nitrophenyl)methoxy]phenyl]-2-(phenylcarbonyl)prop-2-enenitrile Openeye Name: (E)-2-benzoyl-3-[5-bromo-2-[(4-nitrophenyl)methoxy]phenyl]prop-2-enenitrile CAS Name: (E)-2-benzoyl-3-[5-bromo-2-[(4-nitrophenyl)methoxy]phenyl]-2-propenenitrile IUPAC Name: (E)-2-benzoyl-3-[5-bromo-2-[(4-nitrophenyl)methoxy]phenyl]prop-2-enenitrile Traditional Name: (E)-2-benzoyl-3-[5-bromo-2-(4-nitrobenzyl)oxy-phenyl]acrylonitrile Formula: C23H15BrN2O4 MolecularWeight: 463.2802

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C(=CC2=C(C=CC(=C2)Br)OCC3=CC=C(C=C3)[N+](=O)[O-])C#N

Isomeric SMILES

C1=CC=C(C=C1)C(=O)/C(=C/C2=C(C=CC(=C2)Br)OCC3=CC=C(C=C3)[N+](=O)[O-])/C#N

InChI

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