methyl 3-[[(E)-3-[4-(furan-2-ylmethylsulfamoyl)phenyl]prop-2-enoyl]oxymethyl]benzoate

Systemtic Name: methyl 3-[[(E)-3-[4-(furan-2-ylmethylsulfamoyl)phenyl]prop-2-enoyl]oxymethyl]benzoate Openeye Name: methyl 3-[[(E)-3-[4-(2-furylmethylsulfamoyl)phenyl]prop-2-enoyl]oxymethyl]benzoate CAS Name: 3-[[(E)-3-[4-(2-furanylmethylsulfamoyl)phenyl]-1-oxoprop-2-enoxy]methyl]benzoic acid methyl ester IUPAC Name: methyl 3-[[(E)-3-[4-(furan-2-ylmethylsulfamoyl)phenyl]prop-2-enoyl]oxymethyl]benzoate Traditional Name: 3-[[(E)-3-[4-(2-furfurylsulfamoyl)phenyl]acryloyl]oxymethyl]benzoic acid methyl ester Formula: C23H21NO7S MolecularWeight: 455.48034

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)COC(=O)C=CC2=CC=C(C=C2)S(=O)(=O)NCC3=CC=CO3

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)COC(=O)/C=C/C2=CC=C(C=C2)S(=O)(=O)NCC3=CC=CO3

InChI

InChI=1S/C23H21NO7S/c1-29-23(26)19-5-2-4-18(14-19)16-31-22(25)12-9-17-7-10-21(11-8-17)32(27,28)24-15-20-6-3-13-30-20/h2-14,24H,15-16H2,1H3/b12-9+