4-methyl-2-[(4-morpholin-4-ylsulfonylphenyl)sulfonylamino]pentanoic acid

Systemtic Name: 4-methyl-2-[(4-morpholin-4-ylsulfonylphenyl)sulfonylamino]pentanoic acid Openeye Name: 4-methyl-2-[(4-morpholinosulfonylphenyl)sulfonylamino]pentanoic acid CAS Name: 4-methyl-2-[[4-(4-morpholinylsulfonyl)phenyl]sulfonylamino]pentanoic acid IUPAC Name: 4-methyl-2-[(4-morpholin-4-ylsulfonylphenyl)sulfonylamino]pentanoic acid Traditional Name: 4-methyl-2-[(4-morpholinosulfonylphenyl)sulfonylamino]valeric acid Formula: C16H24N2O7S2 MolecularWeight: 420.50096

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)O)NS(=O)(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCOCC2

Isomeric SMILES

CC(C)CC(C(=O)O)NS(=O)(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCOCC2

InChI

InChI=1S/C16H24N2O7S2/c1-12(2)11-15(16(19)20)17-26(21,22)13-3-5-14(6-4-13)27(23,24)18-7-9-25-10-8-18/h3-6,12,15,17H,7-11H2,1-2H3,(H,19,20)