4-nitro-5-[(E)-2-phenylethenyl]thiophene-2-carboxylate

Systemtic Name: 4-nitro-5-[(E)-2-phenylethenyl]thiophene-2-carboxylate Openeye Name: 4-nitro-5-[(E)-styryl]thiophene-2-carboxylate CAS Name: 4-nitro-5-[(E)-2-phenylethenyl]-2-thiophenecarboxylate IUPAC Name: 4-nitro-5-[(E)-2-phenylethenyl]thiophene-2-carboxylate Traditional Name: 4-nitro-5-[(E)-styryl]-2-thenoate Formula: C13H8NO4S- MolecularWeight: 274.27192

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C=CC2=C(C=C(S2)C(=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)/C=C/C2=C(C=C(S2)C(=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C13H9NO4S/c15-13(16)12-8-10(14(17)18)11(19-12)7-6-9-4-2-1-3-5-9/h1-8H,(H,15,16)/p-1/b7-6+