methyl (E)-2-cyano-3-[3-(3-nitrophenyl)sulfonyloxyphenyl]prop-2-enoate

Systemtic Name: methyl (E)-2-cyano-3-[3-(3-nitrophenyl)sulfonyloxyphenyl]prop-2-enoate Openeye Name: methyl (E)-2-cyano-3-[3-(3-nitrophenyl)sulfonyloxyphenyl]prop-2-enoate CAS Name: (E)-2-cyano-3-[3-(3-nitrophenyl)sulfonyloxyphenyl]-2-propenoic acid methyl ester IUPAC Name: methyl (E)-2-cyano-3-[3-(3-nitrophenyl)sulfonyloxyphenyl]prop-2-enoate Traditional Name: (E)-2-cyano-3-[3-(3-nitrophenyl)sulfonyloxyphenyl]acrylic acid methyl ester Formula: C17H12N2O7S MolecularWeight: 388.35138

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(=CC1=CC(=CC=C1)OS(=O)(=O)C2=CC=CC(=C2)[N+](=O)[O-])C#N

Isomeric SMILES

COC(=O)/C(=C/C1=CC(=CC=C1)OS(=O)(=O)C2=CC=CC(=C2)[N+](=O)[O-])/C#N

InChI

InChI=1S/C17H12N2O7S/c1-25-17(20)13(11-18)8-12-4-2-6-15(9-12)26-27(23,24)16-7-3-5-14(10-16)19(21)22/h2-10H,1H3/b13-8+