tert-butyl 2-[1-(4-methylphenyl)sulfonylindol-3-yl]ethanoate

Systemtic Name: tert-butyl 2-[1-(4-methylphenyl)sulfonylindol-3-yl]ethanoate Openeye Name: tert-butyl 2-[1-(p-tolylsulfonyl)indol-3-yl]acetate CAS Name: 2-[1-(4-methylphenyl)sulfonyl-3-indolyl]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[1-(4-methylphenyl)sulfonylindol-3-yl]acetate Traditional Name: 2-(1-tosylindol-3-yl)acetic acid tert-butyl ester Formula: C21H23NO4S MolecularWeight: 385.47662

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C=C(C3=CC=CC=C32)CC(=O)OC(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C=C(C3=CC=CC=C32)CC(=O)OC(C)(C)C

InChI

InChI=1S/C21H23NO4S/c1-15-9-11-17(12-10-15)27(24,25)22-14-16(13-20(23)26-21(2,3)4)18-7-5-6-8-19(18)22/h5-12,14H,13H2,1-4H3