ethyl 1,2-dimethyl-4-(4-methylphenyl)sulfonyl-5-oxidanyl-indole-3-carboxylate

Systemtic Name: ethyl 1,2-dimethyl-4-(4-methylphenyl)sulfonyl-5-oxidanyl-indole-3-carboxylate Openeye Name: ethyl 5-hydroxy-1,2-dimethyl-4-(p-tolylsulfonyl)indole-3-carboxylate CAS Name: 5-hydroxy-1,2-dimethyl-4-(4-methylphenyl)sulfonyl-3-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-hydroxy-1,2-dimethyl-4-(4-methylphenyl)sulfonylindole-3-carboxylate Traditional Name: 5-hydroxy-1,2-dimethyl-4-tosyl-indole-3-carboxylic acid ethyl ester Formula: C20H21NO5S MolecularWeight: 387.44944

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C2=C1C(=C(C=C2)O)S(=O)(=O)C3=CC=C(C=C3)C)C)C

Isomeric SMILES

CCOC(=O)C1=C(N(C2=C1C(=C(C=C2)O)S(=O)(=O)C3=CC=C(C=C3)C)C)C

InChI

InChI=1S/C20H21NO5S/c1-5-26-20(23)17-13(3)21(4)15-10-11-16(22)19(18(15)17)27(24,25)14-8-6-12(2)7-9-14/h6-11,22H,5H2,1-4H3