3-methylbutyl 2-chloranyl-5-sulfamoyl-benzoate

Systemtic Name: 3-methylbutyl 2-chloranyl-5-sulfamoyl-benzoate Openeye Name: isopentyl 2-chloro-5-sulfamoyl-benzoate CAS Name: 2-chloro-5-sulfamoylbenzoic acid 3-methylbutyl ester IUPAC Name: 3-methylbutyl 2-chloro-5-sulfamoylbenzoate Traditional Name: 2-chloro-5-sulfamoyl-benzoic acid isoamyl ester Formula: C12H16ClNO4S MolecularWeight: 305.77774

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC(=O)C1=C(C=CC(=C1)S(=O)(=O)N)Cl

Isomeric SMILES

CC(C)CCOC(=O)C1=C(C=CC(=C1)S(=O)(=O)N)Cl

InChI

InChI=1S/C12H16ClNO4S/c1-8(2)5-6-18-12(15)10-7-9(19(14,16)17)3-4-11(10)13/h3-4,7-8H,5-6H2,1-2H3,(H2,14,16,17)