ethyl 4-[[2-[[(4S)-3,4-dihydro-2H-chromen-4-yl]amino]-2-oxidanylidene-ethyl]sulfamoyl]benzoate

Systemtic Name: ethyl 4-[[2-[[(4S)-3,4-dihydro-2H-chromen-4-yl]amino]-2-oxidanylidene-ethyl]sulfamoyl]benzoate Openeye Name: ethyl 4-[[2-[[(4S)-chroman-4-yl]amino]-2-oxo-ethyl]sulfamoyl]benzoate CAS Name: 4-[[2-[[(4S)-3,4-dihydro-2H-1-benzopyran-4-yl]amino]-2-oxoethyl]sulfamoyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[2-[[(4S)-3,4-dihydro-2H-chromen-4-yl]amino]-2-oxoethyl]sulfamoyl]benzoate Traditional Name: 4-[[2-[[(4S)-chroman-4-yl]amino]-2-keto-ethyl]sulfamoyl]benzoic acid ethyl ester Formula: C20H22N2O6S MolecularWeight: 418.46348

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)S(=O)(=O)NCC(=O)NC2CCOC3=CC=CC=C23

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)S(=O)(=O)NCC(=O)N[C@H]2CCOC3=CC=CC=C23

InChI

InChI=1S/C20H22N2O6S/c1-2-27-20(24)14-7-9-15(10-8-14)29(25,26)21-13-19(23)22-17-11-12-28-18-6-4-3-5-16(17)18/h3-10,17,21H,2,11-13H2,1H3,(H,22,23)/t17-/m0/s1