(E)-3-[4-(furan-2-ylmethylsulfanyl)-3-nitro-phenyl]prop-2-enoate

Systemtic Name: (E)-3-[4-(furan-2-ylmethylsulfanyl)-3-nitro-phenyl]prop-2-enoate Openeye Name: (E)-3-[4-(2-furylmethylsulfanyl)-3-nitro-phenyl]prop-2-enoate CAS Name: (E)-3-[4-(2-furanylmethylthio)-3-nitrophenyl]-2-propenoate IUPAC Name: (E)-3-[4-(furan-2-ylmethylsulfanyl)-3-nitrophenyl]prop-2-enoate Traditional Name: (E)-3-[4-(2-furfurylthio)-3-nitro-phenyl]acrylate Formula: C14H10NO5S- MolecularWeight: 304.2979

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)CSC2=C(C=C(C=C2)C=CC(=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=COC(=C1)CSC2=C(C=C(C=C2)/C=C/C(=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C14H11NO5S/c16-14(17)6-4-10-3-5-13(12(8-10)15(18)19)21-9-11-2-1-7-20-11/h1-8H,9H2,(H,16,17)/p-1/b6-4+