[4-[(3,4-dimethylphenyl)sulfonyl-methyl-amino]phenyl] 2-(4-propanoylphenoxy)ethanoate

Systemtic Name: [4-[(3,4-dimethylphenyl)sulfonyl-methyl-amino]phenyl] 2-(4-propanoylphenoxy)ethanoate Openeye Name: [4-[(3,4-dimethylphenyl)sulfonyl-methyl-amino]phenyl] 2-(4-propanoylphenoxy)acetate CAS Name: 2-[4-(1-oxopropyl)phenoxy]acetic acid [4-[(3,4-dimethylphenyl)sulfonyl-methylamino]phenyl] ester IUPAC Name: [4-[(3,4-dimethylphenyl)sulfonyl-methylamino]phenyl] 2-(4-propanoylphenoxy)acetate Traditional Name: 2-(4-propionylphenoxy)acetic acid [4-[(3,4-dimethylphenyl)sulfonyl-methyl-amino]phenyl] ester Formula: C26H27NO6S MolecularWeight: 481.56068

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=CC=C(C=C1)OCC(=O)OC2=CC=C(C=C2)N(C)S(=O)(=O)C3=CC(=C(C=C3)C)C

Isomeric SMILES

CCC(=O)C1=CC=C(C=C1)OCC(=O)OC2=CC=C(C=C2)N(C)S(=O)(=O)C3=CC(=C(C=C3)C)C

InChI

InChI=1S/C26H27NO6S/c1-5-25(28)20-7-11-22(12-8-20)32-17-26(29)33-23-13-9-21(10-14-23)27(4)34(30,31)24-15-6-18(2)19(3)16-24/h6-16H,5,17H2,1-4H3