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

Systemtic Name: [2-(butylamino)-2-oxidanylidene-ethyl] (2R)-2-methyl-1-methylsulfonyl-2,3-dihydroindole-5-carboxylate Openeye Name: [2-(butylamino)-2-oxo-ethyl] (2R)-2-methyl-1-methylsulfonyl-indoline-5-carboxylate CAS Name: (2R)-2-methyl-1-methylsulfonyl-2,3-dihydroindole-5-carboxylic acid [2-(butylamino)-2-oxoethyl] ester IUPAC Name: [2-(butylamino)-2-oxoethyl] (2R)-2-methyl-1-methylsulfonyl-2,3-dihydroindole-5-carboxylate Traditional Name: (2R)-1-mesyl-2-methyl-indoline-5-carboxylic acid [2-(butylamino)-2-keto-ethyl] ester Formula: C17H24N2O5S MolecularWeight: 368.44786

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H24N2O5S/c1-4-5-8-18-16(20)11-24-17(21)13-6-7-15-14(10-13)9-12(2)19(15)25(3,22)23/h6-7,10,12H,4-5,8-9,11H2,1-3H3,(H,18,20)/t12-/m1/s1