ethyl 4-[(4-azido-3-oxidanyl-butyl)-(4-methylphenyl)sulfonyl-amino]benzoate

Systemtic Name: ethyl 4-[(4-azido-3-oxidanyl-butyl)-(4-methylphenyl)sulfonyl-amino]benzoate Openeye Name: ethyl 4-[(4-azido-3-hydroxy-butyl)-(p-tolylsulfonyl)amino]benzoate CAS Name: 4-[(4-azido-3-hydroxybutyl)-(4-methylphenyl)sulfonylamino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(4-azido-3-hydroxybutyl)-(4-methylphenyl)sulfonylamino]benzoate Traditional Name: 4-[(4-azido-3-hydroxy-butyl)-tosyl-amino]benzoic acid ethyl ester Formula: C20H24N4O5S MolecularWeight: 432.49336

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)N(CCC(CN=[N+]=[N-])O)S(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)N(CCC(CN=[N+]=[N-])O)S(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C20H24N4O5S/c1-3-29-20(26)16-6-8-17(9-7-16)24(13-12-18(25)14-22-23-21)30(27,28)19-10-4-15(2)5-11-19/h4-11,18,25H,3,12-14H2,1-2H3