[4-[(4-methylphenyl)carbonyl-(2,4,5-trimethylphenyl)sulfonyl-amino]phenyl] 4-methylbenzoate

Systemtic Name: [4-[(4-methylphenyl)carbonyl-(2,4,5-trimethylphenyl)sulfonyl-amino]phenyl] 4-methylbenzoate Openeye Name: [4-[(4-methylbenzoyl)-(2,4,5-trimethylphenyl)sulfonyl-amino]phenyl] 4-methylbenzoate CAS Name: 4-methylbenzoic acid [4-[[(4-methylphenyl)-oxomethyl]-(2,4,5-trimethylphenyl)sulfonylamino]phenyl] ester IUPAC Name: [4-[(4-methylbenzoyl)-(2,4,5-trimethylphenyl)sulfonylamino]phenyl] 4-methylbenzoate Traditional Name: 4-methylbenzoic acid [4-[p-toluoyl-(2,4,5-trimethylphenyl)sulfonyl-amino]phenyl] ester Formula: C31H29NO5S MolecularWeight: 527.63066

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N(C2=CC=C(C=C2)OC(=O)C3=CC=C(C=C3)C)S(=O)(=O)C4=C(C=C(C(=C4)C)C)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N(C2=CC=C(C=C2)OC(=O)C3=CC=C(C=C3)C)S(=O)(=O)C4=C(C=C(C(=C4)C)C)C

InChI

InChI=1S/C31H29NO5S/c1-20-6-10-25(11-7-20)30(33)32(38(35,36)29-19-23(4)22(3)18-24(29)5)27-14-16-28(17-15-27)37-31(34)26-12-8-21(2)9-13-26/h6-19H,1-5H3