(E)-3-(4-chloranyl-3-nitro-phenyl)-2-cyano-prop-2-enoic acid

Systemtic Name: (E)-3-(4-chloranyl-3-nitro-phenyl)-2-cyano-prop-2-enoic acid Openeye Name: (E)-3-(4-chloro-3-nitro-phenyl)-2-cyano-prop-2-enoic acid CAS Name: (E)-3-(4-chloro-3-nitrophenyl)-2-cyano-2-propenoic acid IUPAC Name: (E)-3-(4-chloro-3-nitrophenyl)-2-cyanoprop-2-enoic acid Traditional Name: (E)-3-(4-chloro-3-nitro-phenyl)-2-cyano-acrylic acid Formula: C10H5ClN2O4 MolecularWeight: 252.6107

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C=C(C#N)C(=O)O)[N+](=O)[O-])Cl

Isomeric SMILES

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

InChI

InChI=1S/C10H5ClN2O4/c11-8-2-1-6(4-9(8)13(16)17)3-7(5-12)10(14)15/h1-4H,(H,14,15)/b7-3+