methyl 5-bromanyl-2-[[(2S)-2-methyl-2,3-dihydroindol-1-yl]sulfonyl]benzoate

Systemtic Name: methyl 5-bromanyl-2-[[(2S)-2-methyl-2,3-dihydroindol-1-yl]sulfonyl]benzoate Openeye Name: methyl 5-bromo-2-[(2S)-2-methylindolin-1-yl]sulfonyl-benzoate CAS Name: 5-bromo-2-[[(2S)-2-methyl-2,3-dihydroindol-1-yl]sulfonyl]benzoic acid methyl ester IUPAC Name: methyl 5-bromo-2-[[(2S)-2-methyl-2,3-dihydroindol-1-yl]sulfonyl]benzoate Traditional Name: 5-bromo-2-[(2S)-2-methylindolin-1-yl]sulfonyl-benzoic acid methyl ester Formula: C17H16BrNO4S MolecularWeight: 410.28224

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=CC=CC=C2N1S(=O)(=O)C3=C(C=C(C=C3)Br)C(=O)OC

Isomeric SMILES

C[C@H]1CC2=CC=CC=C2N1S(=O)(=O)C3=C(C=C(C=C3)Br)C(=O)OC

InChI

InChI=1S/C17H16BrNO4S/c1-11-9-12-5-3-4-6-15(12)19(11)24(21,22)16-8-7-13(18)10-14(16)17(20)23-2/h3-8,10-11H,9H2,1-2H3/t11-/m0/s1