(4-azido-5-benzamido-6-methoxy-3-oxidanyl-oxan-2-yl)methyl 4-methylbenzenesulfonate

Systemtic Name: (4-azido-5-benzamido-6-methoxy-3-oxidanyl-oxan-2-yl)methyl 4-methylbenzenesulfonate Openeye Name: (4-azido-5-benzamido-3-hydroxy-6-methoxy-tetrahydropyran-2-yl)methyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid (4-azido-5-benzamido-3-hydroxy-6-methoxy-2-oxanyl)methyl ester IUPAC Name: (4-azido-5-benzamido-3-hydroxy-6-methoxyoxan-2-yl)methyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (4-azido-5-benzamido-3-hydroxy-6-methoxy-tetrahydropyran-2-yl)methyl ester Formula: C21H24N4O7S MolecularWeight: 476.50286

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCC2C(C(C(C(O2)OC)NC(=O)C3=CC=CC=C3)N=[N+]=[N-])O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCC2C(C(C(C(O2)OC)NC(=O)C3=CC=CC=C3)N=[N+]=[N-])O

InChI

InChI=1S/C21H24N4O7S/c1-13-8-10-15(11-9-13)33(28,29)31-12-16-19(26)17(24-25-22)18(21(30-2)32-16)23-20(27)14-6-4-3-5-7-14/h3-11,16-19,21,26H,12H2,1-2H3,(H,23,27)