butyl 4-[2-[4-[methyl-(4-methylphenyl)sulfonyl-amino]phenoxy]ethanoylamino]benzoate

Systemtic Name: butyl 4-[2-[4-[methyl-(4-methylphenyl)sulfonyl-amino]phenoxy]ethanoylamino]benzoate Openeye Name: butyl 4-[[2-[4-[methyl(p-tolylsulfonyl)amino]phenoxy]acetyl]amino]benzoate CAS Name: 4-[[2-[4-[methyl-(4-methylphenyl)sulfonylamino]phenoxy]-1-oxoethyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[[2-[4-[methyl-(4-methylphenyl)sulfonylamino]phenoxy]acetyl]amino]benzoate Traditional Name: 4-[[2-[4-[methyl(tosyl)amino]phenoxy]acetyl]amino]benzoic acid butyl ester Formula: C27H30N2O6S MolecularWeight: 510.6019

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)COC2=CC=C(C=C2)N(C)S(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)COC2=CC=C(C=C2)N(C)S(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C27H30N2O6S/c1-4-5-18-34-27(31)21-8-10-22(11-9-21)28-26(30)19-35-24-14-12-23(13-15-24)29(3)36(32,33)25-16-6-20(2)7-17-25/h6-17H,4-5,18-19H2,1-3H3,(H,28,30)