4-[(2Z)-2-[3-tert-butyl-4-(diethylamino)phenyl]-2-methylsulfonylimino-ethoxy]-2-oxidanyl-benzoic acid

Systemtic Name: 4-[(2Z)-2-[3-tert-butyl-4-(diethylamino)phenyl]-2-methylsulfonylimino-ethoxy]-2-oxidanyl-benzoic acid Openeye Name: 4-[(2Z)-2-[3-tert-butyl-4-(diethylamino)phenyl]-2-methylsulfonylimino-ethoxy]-2-hydroxy-benzoic acid CAS Name: 4-[(2Z)-2-[3-tert-butyl-4-(diethylamino)phenyl]-2-methylsulfonyliminoethoxy]-2-hydroxybenzoic acid IUPAC Name: 4-[(2Z)-2-[3-tert-butyl-4-(diethylamino)phenyl]-2-methylsulfonyliminoethoxy]-2-hydroxybenzoic acid Traditional Name: 4-[(2Z)-2-[3-tert-butyl-4-(diethylamino)phenyl]-2-mesylimino-ethoxy]-2-hydroxy-benzoic acid Formula: C24H32N2O6S MolecularWeight: 476.58568

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=C(C=C(C=C1)C(=NS(=O)(=O)C)COC2=CC(=C(C=C2)C(=O)O)O)C(C)(C)C

Isomeric SMILES

CCN(CC)C1=C(C=C(C=C1)/C(=N/S(=O)(=O)C)/COC2=CC(=C(C=C2)C(=O)O)O)C(C)(C)C

InChI

InChI=1S/C24H32N2O6S/c1-7-26(8-2)21-12-9-16(13-19(21)24(3,4)5)20(25-33(6,30)31)15-32-17-10-11-18(23(28)29)22(27)14-17/h9-14,27H,7-8,15H2,1-6H3,(H,28,29)/b25-20+