3-oxidanylidenebutan-2-yl 1-methylsulfonyl-2,3-dihydroindole-5-carboxylate

Systemtic Name: 3-oxidanylidenebutan-2-yl 1-methylsulfonyl-2,3-dihydroindole-5-carboxylate Openeye Name: (1-methyl-2-oxo-propyl) 1-methylsulfonylindoline-5-carboxylate CAS Name: 1-methylsulfonyl-2,3-dihydroindole-5-carboxylic acid 3-oxobutan-2-yl ester IUPAC Name: 3-oxobutan-2-yl 1-methylsulfonyl-2,3-dihydroindole-5-carboxylate Traditional Name: 1-mesylindoline-5-carboxylic acid (2-keto-1-methyl-propyl) ester Formula: C14H17NO5S MolecularWeight: 311.35348

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C)OC(=O)C1=CC2=C(C=C1)N(CC2)S(=O)(=O)C

Isomeric SMILES

CC(C(=O)C)OC(=O)C1=CC2=C(C=C1)N(CC2)S(=O)(=O)C

InChI

InChI=1S/C14H17NO5S/c1-9(16)10(2)20-14(17)12-4-5-13-11(8-12)6-7-15(13)21(3,18)19/h4-5,8,10H,6-7H2,1-3H3