(2-oxidanylideneazepan-3-yl) (E)-3-[4-(furan-2-ylmethylsulfamoyl)phenyl]prop-2-enoate

Systemtic Name: (2-oxidanylideneazepan-3-yl) (E)-3-[4-(furan-2-ylmethylsulfamoyl)phenyl]prop-2-enoate Openeye Name: (2-oxoazepan-3-yl) (E)-3-[4-(2-furylmethylsulfamoyl)phenyl]prop-2-enoate CAS Name: (E)-3-[4-(2-furanylmethylsulfamoyl)phenyl]-2-propenoic acid (2-oxo-3-azepanyl) ester IUPAC Name: (2-oxoazepan-3-yl) (E)-3-[4-(furan-2-ylmethylsulfamoyl)phenyl]prop-2-enoate Traditional Name: (E)-3-[4-(2-furfurylsulfamoyl)phenyl]acrylic acid (2-ketoazepan-3-yl) ester Formula: C20H22N2O6S MolecularWeight: 418.46348

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Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(=O)C(C1)OC(=O)C=CC2=CC=C(C=C2)S(=O)(=O)NCC3=CC=CO3

Isomeric SMILES

C1CCNC(=O)C(C1)OC(=O)/C=C/C2=CC=C(C=C2)S(=O)(=O)NCC3=CC=CO3

InChI

InChI=1S/C20H22N2O6S/c23-19(28-18-5-1-2-12-21-20(18)24)11-8-15-6-9-17(10-7-15)29(25,26)22-14-16-4-3-13-27-16/h3-4,6-11,13,18,22H,1-2,5,12,14H2,(H,21,24)/b11-8+