[4-[(3,4-dimethylphenyl)sulfonyl-methyl-amino]phenyl] 3-(2,3-dimethoxyphenyl)propanoate

Systemtic Name: [4-[(3,4-dimethylphenyl)sulfonyl-methyl-amino]phenyl] 3-(2,3-dimethoxyphenyl)propanoate Openeye Name: [4-[(3,4-dimethylphenyl)sulfonyl-methyl-amino]phenyl] 3-(2,3-dimethoxyphenyl)propanoate CAS Name: 3-(2,3-dimethoxyphenyl)propanoic acid [4-[(3,4-dimethylphenyl)sulfonyl-methylamino]phenyl] ester IUPAC Name: [4-[(3,4-dimethylphenyl)sulfonyl-methylamino]phenyl] 3-(2,3-dimethoxyphenyl)propanoate Traditional Name: 3-(2,3-dimethoxyphenyl)propionic acid [4-[(3,4-dimethylphenyl)sulfonyl-methyl-amino]phenyl] ester Formula: C26H29NO6S MolecularWeight: 483.57656

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N(C)C2=CC=C(C=C2)OC(=O)CCC3=C(C(=CC=C3)OC)OC)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N(C)C2=CC=C(C=C2)OC(=O)CCC3=C(C(=CC=C3)OC)OC)C

InChI

InChI=1S/C26H29NO6S/c1-18-9-15-23(17-19(18)2)34(29,30)27(3)21-11-13-22(14-12-21)33-25(28)16-10-20-7-6-8-24(31-4)26(20)32-5/h6-9,11-15,17H,10,16H2,1-5H3