methyl 3-[[3-[(2R)-2-(ethylsulfonylamino)-3-oxidanylidene-propyl]-1H-indol-5-yl]oxymethyl]benzoate

Systemtic Name: methyl 3-[[3-[(2R)-2-(ethylsulfonylamino)-3-oxidanylidene-propyl]-1H-indol-5-yl]oxymethyl]benzoate Openeye Name: methyl 3-[[3-[(2R)-2-(ethylsulfonylamino)-3-oxo-propyl]-1H-indol-5-yl]oxymethyl]benzoate CAS Name: 3-[[3-[(2R)-2-(ethylsulfonylamino)-3-oxopropyl]-1H-indol-5-yl]oxymethyl]benzoic acid methyl ester IUPAC Name: methyl 3-[[3-[(2R)-2-(ethylsulfonylamino)-3-oxopropyl]-1H-indol-5-yl]oxymethyl]benzoate Traditional Name: 3-[[3-[(2R)-2-(esylamino)-3-keto-propyl]-1H-indol-5-yl]oxymethyl]benzoic acid methyl ester Formula: C22H24N2O6S MolecularWeight: 444.50076

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)NC(CC1=CNC2=C1C=C(C=C2)OCC3=CC=CC(=C3)C(=O)OC)C=O

Isomeric SMILES

CCS(=O)(=O)N[C@H](CC1=CNC2=C1C=C(C=C2)OCC3=CC=CC(=C3)C(=O)OC)C=O

InChI

InChI=1S/C22H24N2O6S/c1-3-31(27,28)24-18(13-25)10-17-12-23-21-8-7-19(11-20(17)21)30-14-15-5-4-6-16(9-15)22(26)29-2/h4-9,11-13,18,23-24H,3,10,14H2,1-2H3/t18-/m1/s1