(E)-3-(4-methylsulfanylphenyl)-2-(4-nitrophenyl)prop-2-enoic acid

Systemtic Name: (E)-3-(4-methylsulfanylphenyl)-2-(4-nitrophenyl)prop-2-enoic acid Openeye Name: (E)-3-(4-methylsulfanylphenyl)-2-(4-nitrophenyl)prop-2-enoic acid CAS Name: (E)-3-[4-(methylthio)phenyl]-2-(4-nitrophenyl)-2-propenoic acid IUPAC Name: (E)-3-(4-methylsulfanylphenyl)-2-(4-nitrophenyl)prop-2-enoic acid Traditional Name: (E)-3-[4-(methylthio)phenyl]-2-(4-nitrophenyl)acrylic acid Formula: C16H13NO4S MolecularWeight: 315.34372

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C=C(C2=CC=C(C=C2)[N+](=O)[O-])C(=O)O

Isomeric SMILES

CSC1=CC=C(C=C1)/C=C(\C2=CC=C(C=C2)[N+](=O)[O-])/C(=O)O

InChI

InChI=1S/C16H13NO4S/c1-22-14-8-2-11(3-9-14)10-15(16(18)19)12-4-6-13(7-5-12)17(20)21/h2-10H,1H3,(H,18,19)/b15-10+