2-(3,4-dimethoxyphenyl)-3-(3-nitro-4-propan-2-yl-phenyl)prop-2-enenitrile

Systemtic Name: 2-(3,4-dimethoxyphenyl)-3-(3-nitro-4-propan-2-yl-phenyl)prop-2-enenitrile Openeye Name: 2-(3,4-dimethoxyphenyl)-3-(4-isopropyl-3-nitro-phenyl)prop-2-enenitrile CAS Name: 2-(3,4-dimethoxyphenyl)-3-(3-nitro-4-propan-2-ylphenyl)-2-propenenitrile IUPAC Name: 2-(3,4-dimethoxyphenyl)-3-(3-nitro-4-propan-2-ylphenyl)prop-2-enenitrile Traditional Name: 2-(3,4-dimethoxyphenyl)-3-(4-isopropyl-3-nitro-phenyl)acrylonitrile Formula: C20H20N2O4 MolecularWeight: 352.3838

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H20N2O4/c1-13(2)17-7-5-14(10-18(17)22(23)24)9-16(12-21)15-6-8-19(25-3)20(11-15)26-4/h5-11,13H,1-4H3