methyl (2R,3S)-2-[[4-(diethylsulfamoyl)phenyl]sulfonylamino]-3-methyl-pentanoate

Systemtic Name: methyl (2R,3S)-2-[[4-(diethylsulfamoyl)phenyl]sulfonylamino]-3-methyl-pentanoate Openeye Name: methyl (2R,3S)-2-[[4-(diethylsulfamoyl)phenyl]sulfonylamino]-3-methyl-pentanoate CAS Name: (2R,3S)-2-[[4-(diethylsulfamoyl)phenyl]sulfonylamino]-3-methylpentanoic acid methyl ester IUPAC Name: methyl (2R,3S)-2-[[4-(diethylsulfamoyl)phenyl]sulfonylamino]-3-methylpentanoate Traditional Name: (2R,3S)-2-[[4-(diethylsulfamoyl)phenyl]sulfonylamino]-3-methyl-valeric acid methyl ester Formula: C17H28N2O6S2 MolecularWeight: 420.54402

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)OC)NS(=O)(=O)C1=CC=C(C=C1)S(=O)(=O)N(CC)CC

Isomeric SMILES

CC[C@H](C)[C@H](C(=O)OC)NS(=O)(=O)C1=CC=C(C=C1)S(=O)(=O)N(CC)CC

InChI

InChI=1S/C17H28N2O6S2/c1-6-13(4)16(17(20)25-5)18-26(21,22)14-9-11-15(12-10-14)27(23,24)19(7-2)8-3/h9-13,16,18H,6-8H2,1-5H3/t13-,16+/m0/s1