(2S)-2-[(4-cyclohexylphenyl)sulfonylamino]-3-methyl-butanoic acid

Systemtic Name: (2S)-2-[(4-cyclohexylphenyl)sulfonylamino]-3-methyl-butanoic acid Openeye Name: (2S)-2-[(4-cyclohexylphenyl)sulfonylamino]-3-methyl-butanoic acid CAS Name: (2S)-2-[(4-cyclohexylphenyl)sulfonylamino]-3-methylbutanoic acid IUPAC Name: (2S)-2-[(4-cyclohexylphenyl)sulfonylamino]-3-methylbutanoic acid Traditional Name: (2S)-2-[(4-cyclohexylphenyl)sulfonylamino]-3-methyl-butyric acid Formula: C17H25NO4S MolecularWeight: 339.4497

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)NS(=O)(=O)C1=CC=C(C=C1)C2CCCCC2

Isomeric SMILES

CC(C)[C@@H](C(=O)O)NS(=O)(=O)C1=CC=C(C=C1)C2CCCCC2

InChI

InChI=1S/C17H25NO4S/c1-12(2)16(17(19)20)18-23(21,22)15-10-8-14(9-11-15)13-6-4-3-5-7-13/h8-13,16,18H,3-7H2,1-2H3,(H,19,20)/t16-/m0/s1