[2-oxidanylidene-2-(prop-2-enylamino)ethyl] 3-[[(2R)-2-methyl-2,3-dihydroindol-1-yl]sulfonyl]benzoate

Systemtic Name: [2-oxidanylidene-2-(prop-2-enylamino)ethyl] 3-[[(2R)-2-methyl-2,3-dihydroindol-1-yl]sulfonyl]benzoate Openeye Name: [2-(allylamino)-2-oxo-ethyl] 3-[(2R)-2-methylindolin-1-yl]sulfonylbenzoate CAS Name: 3-[[(2R)-2-methyl-2,3-dihydroindol-1-yl]sulfonyl]benzoic acid [2-oxo-2-(prop-2-enylamino)ethyl] ester IUPAC Name: [2-oxo-2-(prop-2-enylamino)ethyl] 3-[[(2R)-2-methyl-2,3-dihydroindol-1-yl]sulfonyl]benzoate Traditional Name: 3-[(2R)-2-methylindolin-1-yl]sulfonylbenzoic acid [2-(allylamino)-2-keto-ethyl] ester Formula: C21H22N2O5S MolecularWeight: 414.47478

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=CC=CC=C2N1S(=O)(=O)C3=CC=CC(=C3)C(=O)OCC(=O)NCC=C

Isomeric SMILES

C[C@@H]1CC2=CC=CC=C2N1S(=O)(=O)C3=CC=CC(=C3)C(=O)OCC(=O)NCC=C

InChI

InChI=1S/C21H22N2O5S/c1-3-11-22-20(24)14-28-21(25)17-8-6-9-18(13-17)29(26,27)23-15(2)12-16-7-4-5-10-19(16)23/h3-10,13,15H,1,11-12,14H2,2H3,(H,22,24)/t15-/m1/s1