ethyl 3-[1-(4-methylphenyl)sulfonylpropyl]-1H-indole-2-carboxylate

Systemtic Name: ethyl 3-[1-(4-methylphenyl)sulfonylpropyl]-1H-indole-2-carboxylate Openeye Name: ethyl 3-[1-(p-tolylsulfonyl)propyl]-1H-indole-2-carboxylate CAS Name: 3-[1-(4-methylphenyl)sulfonylpropyl]-1H-indole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 3-[1-(4-methylphenyl)sulfonylpropyl]-1H-indole-2-carboxylate Traditional Name: 3-(1-tosylpropyl)-1H-indole-2-carboxylic acid ethyl ester Formula: C21H23NO4S MolecularWeight: 385.47662

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=C(NC2=CC=CC=C21)C(=O)OCC)S(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCC(C1=C(NC2=CC=CC=C21)C(=O)OCC)S(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C21H23NO4S/c1-4-18(27(24,25)15-12-10-14(3)11-13-15)19-16-8-6-7-9-17(16)22-20(19)21(23)26-5-2/h6-13,18,22H,4-5H2,1-3H3