(4-methylsulfanylphenyl)methyl (E)-3-(5-nitrofuran-2-yl)prop-2-enoate

Systemtic Name: (4-methylsulfanylphenyl)methyl (E)-3-(5-nitrofuran-2-yl)prop-2-enoate Openeye Name: (4-methylsulfanylphenyl)methyl (E)-3-(5-nitro-2-furyl)prop-2-enoate CAS Name: (E)-3-(5-nitro-2-furanyl)-2-propenoic acid [4-(methylthio)phenyl]methyl ester IUPAC Name: (4-methylsulfanylphenyl)methyl (E)-3-(5-nitrofuran-2-yl)prop-2-enoate Traditional Name: (E)-3-(5-nitro-2-furyl)acrylic acid [4-(methylthio)benzyl] ester Formula: C15H13NO5S MolecularWeight: 319.33242

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)COC(=O)C=CC2=CC=C(O2)[N+](=O)[O-]

Isomeric SMILES

CSC1=CC=C(C=C1)COC(=O)/C=C/C2=CC=C(O2)[N+](=O)[O-]

InChI

InChI=1S/C15H13NO5S/c1-22-13-6-2-11(3-7-13)10-20-15(17)9-5-12-4-8-14(21-12)16(18)19/h2-9H,10H2,1H3/b9-5+