[2-(2-methyl-2,3-dihydroindol-1-yl)-2-oxidanylidene-ethyl] 5-morpholin-4-ylsulfonyl-2-oxidanyl-benzoate

Systemtic Name: [2-(2-methyl-2,3-dihydroindol-1-yl)-2-oxidanylidene-ethyl] 5-morpholin-4-ylsulfonyl-2-oxidanyl-benzoate Openeye Name: [2-(2-methylindolin-1-yl)-2-oxo-ethyl] 2-hydroxy-5-morpholinosulfonyl-benzoate CAS Name: 2-hydroxy-5-(4-morpholinylsulfonyl)benzoic acid [2-(2-methyl-2,3-dihydroindol-1-yl)-2-oxoethyl] ester IUPAC Name: [2-(2-methyl-2,3-dihydroindol-1-yl)-2-oxoethyl] 2-hydroxy-5-morpholin-4-ylsulfonylbenzoate Traditional Name: 2-hydroxy-5-morpholinosulfonyl-benzoic acid [2-keto-2-(2-methylindolin-1-yl)ethyl] ester Formula: C22H24N2O7S MolecularWeight: 460.50016

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=CC=CC=C2N1C(=O)COC(=O)C3=C(C=CC(=C3)S(=O)(=O)N4CCOCC4)O

Isomeric SMILES

CC1CC2=CC=CC=C2N1C(=O)COC(=O)C3=C(C=CC(=C3)S(=O)(=O)N4CCOCC4)O

InChI

InChI=1S/C22H24N2O7S/c1-15-12-16-4-2-3-5-19(16)24(15)21(26)14-31-22(27)18-13-17(6-7-20(18)25)32(28,29)23-8-10-30-11-9-23/h2-7,13,15,25H,8-12,14H2,1H3