ethyl 3-[[(2R)-1-(1H-indol-3-yl)-3-oxidanylidene-propan-2-yl]sulfamoylmethyl]benzoate

Systemtic Name: ethyl 3-[[(2R)-1-(1H-indol-3-yl)-3-oxidanylidene-propan-2-yl]sulfamoylmethyl]benzoate Openeye Name: ethyl 3-[[(1R)-1-formyl-2-(1H-indol-3-yl)ethyl]sulfamoylmethyl]benzoate CAS Name: 3-[[(2R)-1-(1H-indol-3-yl)-3-oxopropan-2-yl]sulfamoylmethyl]benzoic acid ethyl ester IUPAC Name: ethyl 3-[[(2R)-1-(1H-indol-3-yl)-3-oxopropan-2-yl]sulfamoylmethyl]benzoate Traditional Name: 3-[[(1R)-1-formyl-2-(1H-indol-3-yl)ethyl]sulfamoylmethyl]benzoic acid ethyl ester Formula: C21H22N2O5S MolecularWeight: 414.47478

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC=C1)CS(=O)(=O)NC(CC2=CNC3=CC=CC=C32)C=O

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)CS(=O)(=O)N[C@H](CC2=CNC3=CC=CC=C32)C=O

InChI

InChI=1S/C21H22N2O5S/c1-2-28-21(25)16-7-5-6-15(10-16)14-29(26,27)23-18(13-24)11-17-12-22-20-9-4-3-8-19(17)20/h3-10,12-13,18,22-23H,2,11,14H2,1H3/t18-/m1/s1