(E)-3-(2-ethyl-3-nitro-phenyl)prop-2-enoic acid

Systemtic Name: (E)-3-(2-ethyl-3-nitro-phenyl)prop-2-enoic acid Openeye Name: (E)-3-(2-ethyl-3-nitro-phenyl)prop-2-enoic acid CAS Name: (E)-3-(2-ethyl-3-nitrophenyl)-2-propenoic acid IUPAC Name: (E)-3-(2-ethyl-3-nitrophenyl)prop-2-enoic acid Traditional Name: (E)-3-(2-ethyl-3-nitro-phenyl)acrylic acid Formula: C11H11NO4 MolecularWeight: 221.20934

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC=C1[N+](=O)[O-])C=CC(=O)O

Isomeric SMILES

CCC1=C(C=CC=C1[N+](=O)[O-])/C=C/C(=O)O

InChI

InChI=1S/C11H11NO4/c1-2-9-8(6-7-11(13)14)4-3-5-10(9)12(15)16/h3-7H,2H2,1H3,(H,13,14)/b7-6+