1,3-benzodioxol-5-yl (2S)-2-methyl-1-methylsulfonyl-2,3-dihydroindole-5-carboxylate

Systemtic Name: 1,3-benzodioxol-5-yl (2S)-2-methyl-1-methylsulfonyl-2,3-dihydroindole-5-carboxylate Openeye Name: 1,3-benzodioxol-5-yl (2S)-2-methyl-1-methylsulfonyl-indoline-5-carboxylate CAS Name: (2S)-2-methyl-1-methylsulfonyl-2,3-dihydroindole-5-carboxylic acid 1,3-benzodioxol-5-yl ester IUPAC Name: 1,3-benzodioxol-5-yl (2S)-2-methyl-1-methylsulfonyl-2,3-dihydroindole-5-carboxylate Traditional Name: (2S)-1-mesyl-2-methyl-indoline-5-carboxylic acid 1,3-benzodioxol-5-yl ester Formula: C18H17NO6S MolecularWeight: 375.39568

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=C(N1S(=O)(=O)C)C=CC(=C2)C(=O)OC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C[C@H]1CC2=C(N1S(=O)(=O)C)C=CC(=C2)C(=O)OC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C18H17NO6S/c1-11-7-13-8-12(3-5-15(13)19(11)26(2,21)22)18(20)25-14-4-6-16-17(9-14)24-10-23-16/h3-6,8-9,11H,7,10H2,1-2H3/t11-/m0/s1