(2S)-2-[(3-ethanoylphenyl)sulfonylamino]-4-methyl-pentanoate

Systemtic Name: (2S)-2-[(3-ethanoylphenyl)sulfonylamino]-4-methyl-pentanoate Openeye Name: (2S)-2-[(3-acetylphenyl)sulfonylamino]-4-methyl-pentanoate CAS Name: (2S)-2-[(3-acetylphenyl)sulfonylamino]-4-methylpentanoate IUPAC Name: (2S)-2-[(3-acetylphenyl)sulfonylamino]-4-methylpentanoate Traditional Name: (2S)-2-[(3-acetylphenyl)sulfonylamino]-4-methyl-valerate Formula: C14H18NO5S- MolecularWeight: 312.36142

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)[O-])NS(=O)(=O)C1=CC=CC(=C1)C(=O)C

Isomeric SMILES

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

InChI

InChI=1S/C14H19NO5S/c1-9(2)7-13(14(17)18)15-21(19,20)12-6-4-5-11(8-12)10(3)16/h4-6,8-9,13,15H,7H2,1-3H3,(H,17,18)/p-1/t13-/m0/s1