diethyl (2E,4S,5R,6E)-4-azido-5-(4-methylphenyl)sulfonyloxy-octa-2,6-dienedioate

Systemtic Name: diethyl (2E,4S,5R,6E)-4-azido-5-(4-methylphenyl)sulfonyloxy-octa-2,6-dienedioate Openeye Name: diethyl (2E,4S,5R,6E)-4-azido-5-(p-tolylsulfonyloxy)octa-2,6-dienedioate CAS Name: (2E,4S,5R,6E)-4-azido-5-(4-methylphenyl)sulfonyloxyocta-2,6-dienedioic acid diethyl ester IUPAC Name: diethyl (2E,4S,5R,6E)-4-azido-5-(4-methylphenyl)sulfonyloxyocta-2,6-dienedioate Traditional Name: (2E,4S,5R,6E)-4-azido-5-tosyloxy-octa-2,6-dienedioic acid diethyl ester Formula: C19H23N3O7S MolecularWeight: 437.46682

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CC(C(C=CC(=O)OCC)OS(=O)(=O)C1=CC=C(C=C1)C)N=[N+]=[N-]

Isomeric SMILES

CCOC(=O)/C=C/[C@@H]([C@@H](/C=C/C(=O)OCC)OS(=O)(=O)C1=CC=C(C=C1)C)N=[N+]=[N-]

InChI

InChI=1S/C19H23N3O7S/c1-4-27-18(23)12-10-16(21-22-20)17(11-13-19(24)28-5-2)29-30(25,26)15-8-6-14(3)7-9-15/h6-13,16-17H,4-5H2,1-3H3/b12-10+,13-11+/t16-,17+/m0/s1