ethyl 4-morpholin-4-yl-3-[(phenylmethyl)amino]-5-sulfamoyl-benzoate

Systemtic Name: ethyl 4-morpholin-4-yl-3-[(phenylmethyl)amino]-5-sulfamoyl-benzoate Openeye Name: ethyl 3-(benzylamino)-4-morpholino-5-sulfamoyl-benzoate CAS Name: 4-(4-morpholinyl)-3-[(phenylmethyl)amino]-5-sulfamoylbenzoic acid ethyl ester IUPAC Name: ethyl 3-(benzylamino)-4-morpholin-4-yl-5-sulfamoylbenzoate Traditional Name: 3-(benzylamino)-4-morpholino-5-sulfamoyl-benzoic acid ethyl ester Formula: C20H25N3O5S MolecularWeight: 419.4946

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(C(=C1)S(=O)(=O)N)N2CCOCC2)NCC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=CC(=C(C(=C1)S(=O)(=O)N)N2CCOCC2)NCC3=CC=CC=C3

InChI

InChI=1S/C20H25N3O5S/c1-2-28-20(24)16-12-17(22-14-15-6-4-3-5-7-15)19(18(13-16)29(21,25)26)23-8-10-27-11-9-23/h3-7,12-13,22H,2,8-11,14H2,1H3,(H2,21,25,26)