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

Systemtic Name: methyl (2S)-2-[(3-ethanoylphenyl)sulfonylamino]-4-methyl-pentanoate Openeye Name: methyl (2S)-2-[(3-acetylphenyl)sulfonylamino]-4-methyl-pentanoate CAS Name: (2S)-2-[(3-acetylphenyl)sulfonylamino]-4-methylpentanoic acid methyl ester IUPAC Name: methyl (2S)-2-[(3-acetylphenyl)sulfonylamino]-4-methylpentanoate Traditional Name: (2S)-2-[(3-acetylphenyl)sulfonylamino]-4-methyl-valeric acid methyl ester Formula: C15H21NO5S MolecularWeight: 327.39594

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H21NO5S/c1-10(2)8-14(15(18)21-4)16-22(19,20)13-7-5-6-12(9-13)11(3)17/h5-7,9-10,14,16H,8H2,1-4H3/t14-/m0/s1