(2S)-2-[(4-acetamidophenyl)sulfonylamino]-3-methyl-pentanoic acid

Systemtic Name: (2S)-2-[(4-acetamidophenyl)sulfonylamino]-3-methyl-pentanoic acid Openeye Name: (2S)-2-[(4-acetamidophenyl)sulfonylamino]-3-methyl-pentanoic acid CAS Name: (2S)-2-[(4-acetamidophenyl)sulfonylamino]-3-methylpentanoic acid IUPAC Name: (2S)-2-[(4-acetamidophenyl)sulfonylamino]-3-methylpentanoic acid Traditional Name: (2S)-2-[(4-acetamidophenyl)sulfonylamino]-3-methyl-valeric acid Formula: C14H20N2O5S MolecularWeight: 328.384

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)O)NS(=O)(=O)C1=CC=C(C=C1)NC(=O)C

Isomeric SMILES

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

InChI

InChI=1S/C14H20N2O5S/c1-4-9(2)13(14(18)19)16-22(20,21)12-7-5-11(6-8-12)15-10(3)17/h5-9,13,16H,4H2,1-3H3,(H,15,17)(H,18,19)/t9?,13-/m0/s1