(E)-3-[3-(2-dimethylaminoethyloxy)-4-nitro-phenyl]prop-2-enal

Systemtic Name: (E)-3-[3-(2-dimethylaminoethyloxy)-4-nitro-phenyl]prop-2-enal Openeye Name: (E)-3-[3-(2-dimethylaminoethyloxy)-4-nitro-phenyl]prop-2-enal CAS Name: (E)-3-[3-(2-dimethylaminoethyloxy)-4-nitrophenyl]-2-propenal IUPAC Name: (E)-3-[3-(2-dimethylaminoethyloxy)-4-nitrophenyl]prop-2-enal Traditional Name: (E)-3-[3-(2-dimethylaminoethyloxy)-4-nitro-phenyl]acrolein Formula: C13H16N2O4 MolecularWeight: 264.27714

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCOC1=C(C=CC(=C1)C=CC=O)[N+](=O)[O-]

Isomeric SMILES

CN(C)CCOC1=C(C=CC(=C1)/C=C/C=O)[N+](=O)[O-]

InChI

InChI=1S/C13H16N2O4/c1-14(2)7-9-19-13-10-11(4-3-8-16)5-6-12(13)15(17)18/h3-6,8,10H,7,9H2,1-2H3/b4-3+