(E)-3-(4-nitro-3-phenylmethoxy-phenyl)prop-2-enenitrile

Systemtic Name: (E)-3-(4-nitro-3-phenylmethoxy-phenyl)prop-2-enenitrile Openeye Name: (E)-3-(3-benzyloxy-4-nitro-phenyl)prop-2-enenitrile CAS Name: (E)-3-(4-nitro-3-phenylmethoxyphenyl)-2-propenenitrile IUPAC Name: (E)-3-(4-nitro-3-phenylmethoxyphenyl)prop-2-enenitrile Traditional Name: (E)-3-(3-benzoxy-4-nitro-phenyl)acrylonitrile Formula: C16H12N2O3 MolecularWeight: 280.27808

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=C(C=CC(=C2)C=CC#N)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C16H12N2O3/c17-10-4-7-13-8-9-15(18(19)20)16(11-13)21-12-14-5-2-1-3-6-14/h1-9,11H,12H2/b7-4+