quinolin-8-ylmethyl 2-morpholin-4-yl-5-sulfamoyl-benzoate

Systemtic Name: quinolin-8-ylmethyl 2-morpholin-4-yl-5-sulfamoyl-benzoate Openeye Name: 8-quinolylmethyl 2-morpholino-5-sulfamoyl-benzoate CAS Name: 2-(4-morpholinyl)-5-sulfamoylbenzoic acid 8-quinolinylmethyl ester IUPAC Name: quinolin-8-ylmethyl 2-morpholin-4-yl-5-sulfamoylbenzoate Traditional Name: 2-morpholino-5-sulfamoyl-benzoic acid 8-quinolylmethyl ester Formula: C21H21N3O5S MolecularWeight: 427.47354

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=C(C=C2)S(=O)(=O)N)C(=O)OCC3=CC=CC4=C3N=CC=C4

Isomeric SMILES

C1COCCN1C2=C(C=C(C=C2)S(=O)(=O)N)C(=O)OCC3=CC=CC4=C3N=CC=C4

InChI

InChI=1S/C21H21N3O5S/c22-30(26,27)17-6-7-19(24-9-11-28-12-10-24)18(13-17)21(25)29-14-16-4-1-3-15-5-2-8-23-20(15)16/h1-8,13H,9-12,14H2,(H2,22,26,27)