(Z)-3-(3-bromanyl-5-methoxy-4-phenylmethoxy-phenyl)-2-(3-nitrophenyl)prop-2-enenitrile

Systemtic Name: (Z)-3-(3-bromanyl-5-methoxy-4-phenylmethoxy-phenyl)-2-(3-nitrophenyl)prop-2-enenitrile Openeye Name: (Z)-3-(4-benzyloxy-3-bromo-5-methoxy-phenyl)-2-(3-nitrophenyl)prop-2-enenitrile CAS Name: (Z)-3-(3-bromo-5-methoxy-4-phenylmethoxyphenyl)-2-(3-nitrophenyl)-2-propenenitrile IUPAC Name: (Z)-3-(3-bromo-5-methoxy-4-phenylmethoxyphenyl)-2-(3-nitrophenyl)prop-2-enenitrile Traditional Name: (Z)-3-(4-benzoxy-3-bromo-5-methoxy-phenyl)-2-(3-nitrophenyl)acrylonitrile Formula: C23H17BrN2O4 MolecularWeight: 465.29608

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C=C(C#N)C2=CC(=CC=C2)[N+](=O)[O-])Br)OCC3=CC=CC=C3

Isomeric SMILES

COC1=C(C(=CC(=C1)/C=C(\C#N)/C2=CC(=CC=C2)[N+](=O)[O-])Br)OCC3=CC=CC=C3

InChI

InChI=1S/C23H17BrN2O4/c1-29-22-12-17(10-19(14-25)18-8-5-9-20(13-18)26(27)28)11-21(24)23(22)30-15-16-6-3-2-4-7-16/h2-13H,15H2,1H3/b19-10+