3-(2,1,3-benzothiadiazol-5-yl)-4-[(4-nitrophenyl)methyl]-5-oxidanyl-5-(4-phenylmethoxyphenyl)furan-2-one

Systemtic Name: 3-(2,1,3-benzothiadiazol-5-yl)-4-[(4-nitrophenyl)methyl]-5-oxidanyl-5-(4-phenylmethoxyphenyl)furan-2-one Openeye Name: 3-(2,1,3-benzothiadiazol-5-yl)-5-(4-benzyloxyphenyl)-5-hydroxy-4-[(4-nitrophenyl)methyl]furan-2-one CAS Name: 3-(2,1,3-benzothiadiazol-5-yl)-5-hydroxy-4-[(4-nitrophenyl)methyl]-5-(4-phenylmethoxyphenyl)-2-furanone IUPAC Name: 3-(2,1,3-benzothiadiazol-5-yl)-5-hydroxy-4-[(4-nitrophenyl)methyl]-5-(4-phenylmethoxyphenyl)furan-2-one Traditional Name: 5-(4-benzoxyphenyl)-5-hydroxy-4-(4-nitrobenzyl)-3-piazthiol-5-yl-furan-2-one Formula: C30H21N3O6S MolecularWeight: 551.56924

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=C(C=C2)C3(C(=C(C(=O)O3)C4=CC5=NSN=C5C=C4)CC6=CC=C(C=C6)[N+](=O)[O-])O

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=C(C=C2)C3(C(=C(C(=O)O3)C4=CC5=NSN=C5C=C4)CC6=CC=C(C=C6)[N+](=O)[O-])O

InChI

InChI=1S/C30H21N3O6S/c34-29-28(21-8-15-26-27(17-21)32-40-31-26)25(16-19-6-11-23(12-7-19)33(36)37)30(35,39-29)22-9-13-24(14-10-22)38-18-20-4-2-1-3-5-20/h1-15,17,35H,16,18H2