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

Systemtic Name: 4-nitro-5-[(E)-2-(4-phenylmethoxyphenyl)ethenyl]thiophene-2-carboxylate Openeye Name: 5-[(E)-2-(4-benzyloxyphenyl)vinyl]-4-nitro-thiophene-2-carboxylate CAS Name: 4-nitro-5-[(E)-2-(4-phenylmethoxyphenyl)ethenyl]-2-thiophenecarboxylate IUPAC Name: 4-nitro-5-[(E)-2-(4-phenylmethoxyphenyl)ethenyl]thiophene-2-carboxylate Traditional Name: 5-[(E)-2-(4-benzoxyphenyl)vinyl]-4-nitro-2-thenoate Formula: C20H14NO5S- MolecularWeight: 380.39386

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=C(C=C2)C=CC3=C(C=C(S3)C(=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=C(C=C2)/C=C/C3=C(C=C(S3)C(=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C20H15NO5S/c22-20(23)19-12-17(21(24)25)18(27-19)11-8-14-6-9-16(10-7-14)26-13-15-4-2-1-3-5-15/h1-12H,13H2,(H,22,23)/p-1/b11-8+