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

Systemtic Name: (E)-3-(4-azido-2-chloranyl-phenyl)-2-cyano-prop-2-enoic acid Openeye Name: (E)-3-(4-azido-2-chloro-phenyl)-2-cyano-prop-2-enoic acid CAS Name: (E)-3-(4-azido-2-chlorophenyl)-2-cyano-2-propenoic acid IUPAC Name: (E)-3-(4-azido-2-chlorophenyl)-2-cyanoprop-2-enoic acid Traditional Name: (E)-3-(4-azido-2-chloro-phenyl)-2-cyano-acrylic acid Formula: C10H5ClN4O2 MolecularWeight: 248.6253

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1N=[N+]=[N-])Cl)C=C(C#N)C(=O)O

Isomeric SMILES

C1=CC(=C(C=C1N=[N+]=[N-])Cl)/C=C(\C#N)/C(=O)O

InChI

InChI=1S/C10H5ClN4O2/c11-9-4-8(14-15-13)2-1-6(9)3-7(5-12)10(16)17/h1-4H,(H,16,17)/b7-3+