(3-methylquinoxalin-2-yl)methyl 3-(tert-butylsulfamoyl)-4-chloranyl-benzoate

Systemtic Name: (3-methylquinoxalin-2-yl)methyl 3-(tert-butylsulfamoyl)-4-chloranyl-benzoate Openeye Name: (3-methylquinoxalin-2-yl)methyl 3-(tert-butylsulfamoyl)-4-chloro-benzoate CAS Name: 3-(tert-butylsulfamoyl)-4-chlorobenzoic acid (3-methyl-2-quinoxalinyl)methyl ester IUPAC Name: (3-methylquinoxalin-2-yl)methyl 3-(tert-butylsulfamoyl)-4-chlorobenzoate Traditional Name: 3-(tert-butylsulfamoyl)-4-chloro-benzoic acid (3-methylquinoxalin-2-yl)methyl ester Formula: C21H22ClN3O4S MolecularWeight: 447.93508

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2N=C1COC(=O)C3=CC(=C(C=C3)Cl)S(=O)(=O)NC(C)(C)C

Isomeric SMILES

CC1=NC2=CC=CC=C2N=C1COC(=O)C3=CC(=C(C=C3)Cl)S(=O)(=O)NC(C)(C)C

InChI

InChI=1S/C21H22ClN3O4S/c1-13-18(24-17-8-6-5-7-16(17)23-13)12-29-20(26)14-9-10-15(22)19(11-14)30(27,28)25-21(2,3)4/h5-11,25H,12H2,1-4H3