6-[2-azanyl-5-chloranyl-6-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxidanyl-4-sulfamoyl-phenyl]hexanoic acid

Systemtic Name: 6-[2-azanyl-5-chloranyl-6-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxidanyl-4-sulfamoyl-phenyl]hexanoic acid Openeye Name: 6-[2-amino-6-(tert-butoxycarbonylamino)-5-chloro-3-hydroxy-4-sulfamoyl-phenyl]hexanoic acid CAS Name: 6-[2-amino-5-chloro-3-hydroxy-6-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-4-sulfamoylphenyl]hexanoic acid IUPAC Name: 6-[2-amino-5-chloro-3-hydroxy-6-[(2-methylpropan-2-yl)oxycarbonylamino]-4-sulfamoylphenyl]hexanoic acid Traditional Name: 6-[2-amino-6-(tert-butoxycarbonylamino)-5-chloro-3-hydroxy-4-sulfamoyl-phenyl]hexanoic acid Formula: C17H26ClN3O7S MolecularWeight: 451.92224

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1=C(C(=C(C(=C1CCCCCC(=O)O)N)O)S(=O)(=O)N)Cl

Isomeric SMILES

CC(C)(C)OC(=O)NC1=C(C(=C(C(=C1CCCCCC(=O)O)N)O)S(=O)(=O)N)Cl

InChI

InChI=1S/C17H26ClN3O7S/c1-17(2,3)28-16(25)21-13-9(7-5-4-6-8-10(22)23)12(19)14(24)15(11(13)18)29(20,26)27/h24H,4-8,19H2,1-3H3,(H,21,25)(H,22,23)(H2,20,26,27)