tert-butyl (2S,3S)-2-azanyl-3-methyl-pentanoate; N-(phenylsulfonyl)benzenesulfonamide

Systemtic Name: tert-butyl (2S,3S)-2-azanyl-3-methyl-pentanoate; N-(phenylsulfonyl)benzenesulfonamide Openeye Name: N-(benzenesulfonyl)benzenesulfonamide; tert-butyl (2S,3S)-2-amino-3-methyl-pentanoate CAS Name: (2S,3S)-2-amino-3-methylpentanoic acid tert-butyl ester; N-(benzenesulfonyl)benzenesulfonamide IUPAC Name: N-(benzenesulfonyl)benzenesulfonamide; tert-butyl (2S,3S)-2-amino-3-methylpentanoate Traditional Name: (2S,3S)-2-amino-3-methyl-valeric acid tert-butyl ester; N-besylbenzenesulfonamide Formula: C22H32N2O6S2 MolecularWeight: 484.62928

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)OC(C)(C)C)N.C1=CC=C(C=C1)S(=O)(=O)NS(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

CC[C@H](C)[C@@H](C(=O)OC(C)(C)C)N.C1=CC=C(C=C1)S(=O)(=O)NS(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C12H11NO4S2.C10H21NO2/c14-18(15,11-7-3-1-4-8-11)13-19(16,17)12-9-5-2-6-10-12;1-6-7(2)8(11)9(12)13-10(3,4)5/h1-10,13H;7-8H,6,11H2,1-5H3/t;7-,8-/m.0/s1