3-[1-azanyl-4-[2-[4-azanyl-4-(3-oxidanyl-3-oxidanylidene-1-sulfamoyl-propyl)cyclohexyl]propan-2-yl]cyclohexyl]-3-sulfamoyl-propanoic acid

Systemtic Name: 3-[1-azanyl-4-[2-[4-azanyl-4-(3-oxidanyl-3-oxidanylidene-1-sulfamoyl-propyl)cyclohexyl]propan-2-yl]cyclohexyl]-3-sulfamoyl-propanoic acid Openeye Name: 3-[1-amino-4-[1-[4-amino-4-(3-hydroxy-3-oxo-1-sulfamoyl-propyl)cyclohexyl]-1-methyl-ethyl]cyclohexyl]-3-sulfamoyl-propanoic acid CAS Name: 3-[1-amino-4-[2-[4-amino-4-(3-hydroxy-3-oxo-1-sulfamoylpropyl)cyclohexyl]propan-2-yl]cyclohexyl]-3-sulfamoylpropanoic acid IUPAC Name: 3-[1-amino-4-[2-[4-amino-4-(3-hydroxy-3-oxo-1-sulfamoylpropyl)cyclohexyl]propan-2-yl]cyclohexyl]-3-sulfamoylpropanoic acid Traditional Name: 3-[1-amino-4-[1-[4-amino-4-(3-hydroxy-3-keto-1-sulfamoyl-propyl)cyclohexyl]-1-methyl-ethyl]cyclohexyl]-3-sulfamoyl-propionic acid Formula: C21H40N4O8S2 MolecularWeight: 540.6943

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1CCC(CC1)(C(CC(=O)O)S(=O)(=O)N)N)C2CCC(CC2)(C(CC(=O)O)S(=O)(=O)N)N

Isomeric SMILES

CC(C)(C1CCC(CC1)(C(CC(=O)O)S(=O)(=O)N)N)C2CCC(CC2)(C(CC(=O)O)S(=O)(=O)N)N

InChI

InChI=1S/C21H40N4O8S2/c1-19(2,13-3-7-20(22,8-4-13)15(11-17(26)27)34(24,30)31)14-5-9-21(23,10-6-14)16(12-18(28)29)35(25,32)33/h13-16H,3-12,22-23H2,1-2H3,(H,26,27)(H,28,29)(H2,24,30,31)(H2,25,32,33)