(E)-3-(3-nitro-4-oxidanyl-phenyl)-2-(4-propylphenyl)carbonyl-prop-2-enenitrile

Systemtic Name: (E)-3-(3-nitro-4-oxidanyl-phenyl)-2-(4-propylphenyl)carbonyl-prop-2-enenitrile Openeye Name: (E)-3-(4-hydroxy-3-nitro-phenyl)-2-(4-propylbenzoyl)prop-2-enenitrile CAS Name: (E)-3-(4-hydroxy-3-nitrophenyl)-2-[oxo-(4-propylphenyl)methyl]-2-propenenitrile IUPAC Name: (E)-3-(4-hydroxy-3-nitrophenyl)-2-(4-propylbenzoyl)prop-2-enenitrile Traditional Name: (E)-3-(4-hydroxy-3-nitro-phenyl)-2-(4-propylbenzoyl)acrylonitrile Formula: C19H16N2O4 MolecularWeight: 336.34134

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)C(=O)C(=CC2=CC(=C(C=C2)O)[N+](=O)[O-])C#N

Isomeric SMILES

CCCC1=CC=C(C=C1)C(=O)/C(=C/C2=CC(=C(C=C2)O)[N+](=O)[O-])/C#N

InChI

InChI=1S/C19H16N2O4/c1-2-3-13-4-7-15(8-5-13)19(23)16(12-20)10-14-6-9-18(22)17(11-14)21(24)25/h4-11,22H,2-3H2,1H3/b16-10+