N-[(2S,3S)-3-(hydroxymethyl)heptan-2-yl]-4-methyl-benzenesulfonamide

Systemtic Name: N-[(2S,3S)-3-(hydroxymethyl)heptan-2-yl]-4-methyl-benzenesulfonamide Openeye Name: N-[(1S,2S)-2-(hydroxymethyl)-1-methyl-hexyl]-4-methyl-benzenesulfonamide CAS Name: N-[(2S,3S)-3-(hydroxymethyl)heptan-2-yl]-4-methylbenzenesulfonamide IUPAC Name: N-[(2S,3S)-3-(hydroxymethyl)heptan-2-yl]-4-methylbenzenesulfonamide Traditional Name: 4-methyl-N-[(1S,2S)-1-methyl-2-methylol-hexyl]benzenesulfonamide Formula: C15H25NO3S MolecularWeight: 299.4289

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CO)C(C)NS(=O)(=O)C1=CC=C(C=C1)C

Isomeric SMILES

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

InChI

InChI=1S/C15H25NO3S/c1-4-5-6-14(11-17)13(3)16-20(18,19)15-9-7-12(2)8-10-15/h7-10,13-14,16-17H,4-6,11H2,1-3H3/t13-,14+/m0/s1