bis(2-methylsulfonylethyl) 9-methoxy-2-methyl-8-oxidanyl-1-thiophen-2-yl-1H-2-benzazocine-4,5-dicarboxylate

Systemtic Name: bis(2-methylsulfonylethyl) 9-methoxy-2-methyl-8-oxidanyl-1-thiophen-2-yl-1H-2-benzazocine-4,5-dicarboxylate Openeye Name: bis(2-methylsulfonylethyl) 8-hydroxy-9-methoxy-2-methyl-1-(2-thienyl)-1H-2-benzazocine-4,5-dicarboxylate CAS Name: 8-hydroxy-9-methoxy-2-methyl-1-thiophen-2-yl-1H-2-benzazocine-4,5-dicarboxylic acid bis(2-methylsulfonylethyl) ester IUPAC Name: bis(2-methylsulfonylethyl) 8-hydroxy-9-methoxy-2-methyl-1-thiophen-2-yl-1H-2-benzazocine-4,5-dicarboxylate Traditional Name: 8-hydroxy-9-methoxy-2-methyl-1-(2-thienyl)-1H-2-benzazocine-4,5-dicarboxylic acid bis(2-mesylethyl) ester Formula: C25H29NO10S3 MolecularWeight: 599.69346

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=CC2=CC(=C(C=C2C1C3=CC=CS3)OC)O)C(=O)OCCS(=O)(=O)C)C(=O)OCCS(=O)(=O)C

Isomeric SMILES

CN1C=C(C(=CC2=CC(=C(C=C2C1C3=CC=CS3)OC)O)C(=O)OCCS(=O)(=O)C)C(=O)OCCS(=O)(=O)C

InChI

InChI=1S/C25H29NO10S3/c1-26-15-19(25(29)36-8-11-39(4,32)33)18(24(28)35-7-10-38(3,30)31)12-16-13-20(27)21(34-2)14-17(16)23(26)22-6-5-9-37-22/h5-6,9,12-15,23,27H,7-8,10-11H2,1-4H3