ethyl (E)-3-[4-(nitromethyl)phenyl]prop-2-enoate

Systemtic Name: ethyl (E)-3-[4-(nitromethyl)phenyl]prop-2-enoate Openeye Name: ethyl (E)-3-[4-(nitromethyl)phenyl]prop-2-enoate CAS Name: (E)-3-[4-(nitromethyl)phenyl]-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-3-[4-(nitromethyl)phenyl]prop-2-enoate Traditional Name: (E)-3-[4-(nitromethyl)phenyl]acrylic acid ethyl ester Formula: C12H13NO4 MolecularWeight: 235.23592

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CC1=CC=C(C=C1)C[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C12H13NO4/c1-2-17-12(14)8-7-10-3-5-11(6-4-10)9-13(15)16/h3-8H,2,9H2,1H3/b8-7+