[2-[butanoyl-(4-methylphenyl)sulfonyl-amino]phenyl] butanoate

Systemtic Name: [2-[butanoyl-(4-methylphenyl)sulfonyl-amino]phenyl] butanoate Openeye Name: [2-[butanoyl(p-tolylsulfonyl)amino]phenyl] butanoate CAS Name: butanoic acid [2-[(4-methylphenyl)sulfonyl-(1-oxobutyl)amino]phenyl] ester IUPAC Name: [2-[butanoyl-(4-methylphenyl)sulfonylamino]phenyl] butanoate Traditional Name: butyric acid [2-[butyryl(tosyl)amino]phenyl] ester Formula: C21H25NO5S MolecularWeight: 403.4919

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)N(C1=CC=CC=C1OC(=O)CCC)S(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCCC(=O)N(C1=CC=CC=C1OC(=O)CCC)S(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C21H25NO5S/c1-4-8-20(23)22(28(25,26)17-14-12-16(3)13-15-17)18-10-6-7-11-19(18)27-21(24)9-5-2/h6-7,10-15H,4-5,8-9H2,1-3H3