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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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