methyl 2-azido-3,3-dimethyl-4-(4-phenoxyphenyl)sulfonyl-butanoate

Systemtic Name: methyl 2-azido-3,3-dimethyl-4-(4-phenoxyphenyl)sulfonyl-butanoate Openeye Name: methyl 2-azido-3,3-dimethyl-4-(4-phenoxyphenyl)sulfonyl-butanoate CAS Name: 2-azido-3,3-dimethyl-4-(4-phenoxyphenyl)sulfonylbutanoic acid methyl ester IUPAC Name: methyl 2-azido-3,3-dimethyl-4-(4-phenoxyphenyl)sulfonylbutanoate Traditional Name: 2-azido-3,3-dimethyl-4-(4-phenoxyphenyl)sulfonyl-butyric acid methyl ester Formula: C19H21N3O5S MolecularWeight: 403.45214

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CS(=O)(=O)C1=CC=C(C=C1)OC2=CC=CC=C2)C(C(=O)OC)N=[N+]=[N-]

Isomeric SMILES

CC(C)(CS(=O)(=O)C1=CC=C(C=C1)OC2=CC=CC=C2)C(C(=O)OC)N=[N+]=[N-]

InChI

InChI=1S/C19H21N3O5S/c1-19(2,17(21-22-20)18(23)26-3)13-28(24,25)16-11-9-15(10-12-16)27-14-7-5-4-6-8-14/h4-12,17H,13H2,1-3H3