[2-oxidanylidene-2-(pentylamino)ethyl] (2R)-2-methyl-1-methylsulfonyl-2,3-dihydroindole-5-carboxylate

Systemtic Name: [2-oxidanylidene-2-(pentylamino)ethyl] (2R)-2-methyl-1-methylsulfonyl-2,3-dihydroindole-5-carboxylate Openeye Name: [2-oxo-2-(pentylamino)ethyl] (2R)-2-methyl-1-methylsulfonyl-indoline-5-carboxylate CAS Name: (2R)-2-methyl-1-methylsulfonyl-2,3-dihydroindole-5-carboxylic acid [2-oxo-2-(pentylamino)ethyl] ester IUPAC Name: [2-oxo-2-(pentylamino)ethyl] (2R)-2-methyl-1-methylsulfonyl-2,3-dihydroindole-5-carboxylate Traditional Name: (2R)-1-mesyl-2-methyl-indoline-5-carboxylic acid [2-(amylamino)-2-keto-ethyl] ester Formula: C18H26N2O5S MolecularWeight: 382.47444

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=O)COC(=O)C1=CC2=C(C=C1)N(C(C2)C)S(=O)(=O)C

Isomeric SMILES

CCCCCNC(=O)COC(=O)C1=CC2=C(C=C1)N([C@@H](C2)C)S(=O)(=O)C

InChI

InChI=1S/C18H26N2O5S/c1-4-5-6-9-19-17(21)12-25-18(22)14-7-8-16-15(11-14)10-13(2)20(16)26(3,23)24/h7-8,11,13H,4-6,9-10,12H2,1-3H3,(H,19,21)/t13-/m1/s1