3-(4-tert-butylphenyl)-3-(2-methylsulfonylethoxy)-2-propyl-isoindol-1-one

Systemtic Name: 3-(4-tert-butylphenyl)-3-(2-methylsulfonylethoxy)-2-propyl-isoindol-1-one Openeye Name: 3-(4-tert-butylphenyl)-3-(2-methylsulfonylethoxy)-2-propyl-isoindolin-1-one CAS Name: 3-(4-tert-butylphenyl)-3-(2-methylsulfonylethoxy)-2-propyl-1-isoindolone IUPAC Name: 3-(4-tert-butylphenyl)-3-(2-methylsulfonylethoxy)-2-propylisoindol-1-one Traditional Name: 3-(4-tert-butylphenyl)-3-(2-mesylethoxy)-2-propyl-isoindolin-1-one Formula: C24H31NO4S MolecularWeight: 429.57224

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2C1(C3=CC=C(C=C3)C(C)(C)C)OCCS(=O)(=O)C

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2C1(C3=CC=C(C=C3)C(C)(C)C)OCCS(=O)(=O)C

InChI

InChI=1S/C24H31NO4S/c1-6-15-25-22(26)20-9-7-8-10-21(20)24(25,29-16-17-30(5,27)28)19-13-11-18(12-14-19)23(2,3)4/h7-14H,6,15-17H2,1-5H3