methyl 7-(N-aminocarbonyl-S-methyl-sulfonimidoyl)-5-hexyl-9-oxidanylidene-xanthene-2-carboxylate

Systemtic Name: methyl 7-(N-aminocarbonyl-S-methyl-sulfonimidoyl)-5-hexyl-9-oxidanylidene-xanthene-2-carboxylate Openeye Name: methyl 7-(N-carbamoyl-S-methyl-sulfonimidoyl)-5-hexyl-9-oxo-xanthene-2-carboxylate CAS Name: 7-(N-carbamoyl-S-methylsulfonimidoyl)-5-hexyl-9-oxo-2-xanthenecarboxylic acid methyl ester IUPAC Name: methyl 7-(N-carbamoyl-S-methylsulfonimidoyl)-5-hexyl-9-oxoxanthene-2-carboxylate Traditional Name: 7-(N-carbamoyl-S-methyl-sulfonimidoyl)-5-hexyl-9-keto-xanthene-2-carboxylic acid methyl ester Formula: C23H26N2O6S MolecularWeight: 458.52734

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C2C(=CC(=C1)S(=NC(=O)N)(=O)C)C(=O)C3=C(O2)C=CC(=C3)C(=O)OC

Isomeric SMILES

CCCCCCC1=C2C(=CC(=C1)S(=NC(=O)N)(=O)C)C(=O)C3=C(O2)C=CC(=C3)C(=O)OC

InChI

InChI=1S/C23H26N2O6S/c1-4-5-6-7-8-14-11-16(32(3,29)25-23(24)28)13-18-20(26)17-12-15(22(27)30-2)9-10-19(17)31-21(14)18/h9-13H,4-8H2,1-3H3,(H2,24,28)