ethyl 1-(2-hydroxyethylamino)-2-methyl-4-[2-(methylsulfonylamino)phenyl]indole-3-carboperoxoate

Systemtic Name: ethyl 1-(2-hydroxyethylamino)-2-methyl-4-[2-(methylsulfonylamino)phenyl]indole-3-carboperoxoate Openeye Name: ethyl 1-(2-hydroxyethylamino)-4-[2-(methanesulfonamido)phenyl]-2-methyl-indole-3-carboperoxoate CAS Name: 1-(2-hydroxyethylamino)-4-[2-(methanesulfonamido)phenyl]-2-methyl-3-indolecarboperoxoic acid ethyl ester IUPAC Name: ethyl 1-(2-hydroxyethylamino)-4-[2-(methanesulfonamido)phenyl]-2-methylindole-3-carboperoxoate Traditional Name: 1-(2-hydroxyethylamino)-4-[2-(methanesulfonamido)phenyl]-2-methyl-indole-3-carboperoxoic acid ethyl ester Formula: C21H25N3O6S MolecularWeight: 447.5047

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Descriptors Computed from Structure

Canonical SMILES:

CCOOC(=O)C1=C(N(C2=CC=CC(=C21)C3=CC=CC=C3NS(=O)(=O)C)NCCO)C

Isomeric SMILES

CCOOC(=O)C1=C(N(C2=CC=CC(=C21)C3=CC=CC=C3NS(=O)(=O)C)NCCO)C

InChI

InChI=1S/C21H25N3O6S/c1-4-29-30-21(26)19-14(2)24(22-12-13-25)18-11-7-9-16(20(18)19)15-8-5-6-10-17(15)23-31(3,27)28/h5-11,22-23,25H,4,12-13H2,1-3H3