(E)-2-cyano-3-(3-nitrophenyl)prop-2-enoic acid

Systemtic Name: (E)-2-cyano-3-(3-nitrophenyl)prop-2-enoic acid Openeye Name: (E)-2-cyano-3-(3-nitrophenyl)prop-2-enoic acid CAS Name: (E)-2-cyano-3-(3-nitrophenyl)-2-propenoic acid IUPAC Name: (E)-2-cyano-3-(3-nitrophenyl)prop-2-enoic acid Traditional Name: (E)-2-cyano-3-(3-nitrophenyl)acrylic acid Formula: C10H6N2O4 MolecularWeight: 218.16564

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H6N2O4/c11-6-8(10(13)14)4-7-2-1-3-9(5-7)12(15)16/h1-5H,(H,13,14)/b8-4+