(E)-3-[2-nitro-5-(thiophen-3-ylmethoxy)phenyl]-2-phenyl-prop-2-enoic acid

Systemtic Name: (E)-3-[2-nitro-5-(thiophen-3-ylmethoxy)phenyl]-2-phenyl-prop-2-enoic acid Openeye Name: (E)-3-[2-nitro-5-(3-thienylmethoxy)phenyl]-2-phenyl-prop-2-enoic acid CAS Name: (E)-3-[2-nitro-5-(3-thiophenylmethoxy)phenyl]-2-phenyl-2-propenoic acid IUPAC Name: (E)-3-[2-nitro-5-(thiophen-3-ylmethoxy)phenyl]-2-phenylprop-2-enoic acid Traditional Name: (E)-3-[2-nitro-5-(3-thenyloxy)phenyl]-2-phenyl-acrylic acid Formula: C20H15NO5S MolecularWeight: 381.4018

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=CC2=C(C=CC(=C2)OCC3=CSC=C3)[N+](=O)[O-])C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)/C(=C\C2=C(C=CC(=C2)OCC3=CSC=C3)[N+](=O)[O-])/C(=O)O

InChI

InChI=1S/C20H15NO5S/c22-20(23)18(15-4-2-1-3-5-15)11-16-10-17(6-7-19(16)21(24)25)26-12-14-8-9-27-13-14/h1-11,13H,12H2,(H,22,23)/b18-11+