[4-[(3,4-dimethylphenyl)sulfonyl-methyl-amino]phenyl] (2R)-2,3-dihydro-1-benzofuran-2-carboxylate

Systemtic Name: [4-[(3,4-dimethylphenyl)sulfonyl-methyl-amino]phenyl] (2R)-2,3-dihydro-1-benzofuran-2-carboxylate Openeye Name: [4-[(3,4-dimethylphenyl)sulfonyl-methyl-amino]phenyl] (2R)-2,3-dihydrobenzofuran-2-carboxylate CAS Name: (2R)-2,3-dihydrobenzofuran-2-carboxylic acid [4-[(3,4-dimethylphenyl)sulfonyl-methylamino]phenyl] ester IUPAC Name: [4-[(3,4-dimethylphenyl)sulfonyl-methylamino]phenyl] (2R)-2,3-dihydro-1-benzofuran-2-carboxylate Traditional Name: (2R)-coumaran-2-carboxylic acid [4-[(3,4-dimethylphenyl)sulfonyl-methyl-amino]phenyl] ester Formula: C24H23NO5S MolecularWeight: 437.50812

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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)C3CC4=CC=CC=C4O3)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N(C)C2=CC=C(C=C2)OC(=O)[C@H]3CC4=CC=CC=C4O3)C

InChI

InChI=1S/C24H23NO5S/c1-16-8-13-21(14-17(16)2)31(27,28)25(3)19-9-11-20(12-10-19)29-24(26)23-15-18-6-4-5-7-22(18)30-23/h4-14,23H,15H2,1-3H3/t23-/m1/s1