(2S,3S)-2-[(2-bromophenyl)sulfonylamino]-3-methyl-pentanoate

Systemtic Name: (2S,3S)-2-[(2-bromophenyl)sulfonylamino]-3-methyl-pentanoate Openeye Name: (2S,3S)-2-[(2-bromophenyl)sulfonylamino]-3-methyl-pentanoate CAS Name: (2S,3S)-2-[(2-bromophenyl)sulfonylamino]-3-methylpentanoate IUPAC Name: (2S,3S)-2-[(2-bromophenyl)sulfonylamino]-3-methylpentanoate Traditional Name: (2S,3S)-2-[(2-bromophenyl)sulfonylamino]-3-methyl-valerate Formula: C12H15BrNO4S- MolecularWeight: 349.2208

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)[O-])NS(=O)(=O)C1=CC=CC=C1Br

Isomeric SMILES

CC[C@H](C)[C@@H](C(=O)[O-])NS(=O)(=O)C1=CC=CC=C1Br

InChI

InChI=1S/C12H16BrNO4S/c1-3-8(2)11(12(15)16)14-19(17,18)10-7-5-4-6-9(10)13/h4-8,11,14H,3H2,1-2H3,(H,15,16)/p-1/t8-,11-/m0/s1