N-[3-(2,3-dimethoxy-1-oxidanyl-4-oxidanylidene-cyclobut-2-en-1-yl)prop-2-ynyl]-N-(3-phenylprop-2-ynyl)benzenesulfonamide

Systemtic Name: N-[3-(2,3-dimethoxy-1-oxidanyl-4-oxidanylidene-cyclobut-2-en-1-yl)prop-2-ynyl]-N-(3-phenylprop-2-ynyl)benzenesulfonamide Openeye Name: N-[3-(1-hydroxy-2,3-dimethoxy-4-oxo-cyclobut-2-en-1-yl)prop-2-ynyl]-N-(3-phenylprop-2-ynyl)benzenesulfonamide CAS Name: N-[3-(1-hydroxy-2,3-dimethoxy-4-oxo-1-cyclobut-2-enyl)prop-2-ynyl]-N-(3-phenylprop-2-ynyl)benzenesulfonamide IUPAC Name: N-[3-(1-hydroxy-2,3-dimethoxy-4-oxocyclobut-2-en-1-yl)prop-2-ynyl]-N-(3-phenylprop-2-ynyl)benzenesulfonamide Traditional Name: N-[3-(1-hydroxy-4-keto-2,3-dimethoxy-cyclobut-2-en-1-yl)prop-2-ynyl]-N-(3-phenylprop-2-ynyl)benzenesulfonamide Formula: C24H21NO6S MolecularWeight: 451.49164

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(C1=O)(C#CCN(CC#CC2=CC=CC=C2)S(=O)(=O)C3=CC=CC=C3)O)OC

Isomeric SMILES

COC1=C(C(C1=O)(C#CCN(CC#CC2=CC=CC=C2)S(=O)(=O)C3=CC=CC=C3)O)OC

InChI

InChI=1S/C24H21NO6S/c1-30-21-22(26)24(27,23(21)31-2)16-10-18-25(17-9-13-19-11-5-3-6-12-19)32(28,29)20-14-7-4-8-15-20/h3-8,11-12,14-15,27H,17-18H2,1-2H3