methanesulfonic acid; N-[4-(4-oxidanylbutyl)phenyl]methanesulfonamide

Systemtic Name: methanesulfonic acid; N-[4-(4-oxidanylbutyl)phenyl]methanesulfonamide Openeye Name: N-[4-(4-hydroxybutyl)phenyl]methanesulfonamide; methanesulfonic acid CAS Name: N-[4-(4-hydroxybutyl)phenyl]methanesulfonamide; methanesulfonic acid IUPAC Name: N-[4-(4-hydroxybutyl)phenyl]methanesulfonamide; methanesulfonic acid Traditional Name: N-[4-(4-hydroxybutyl)phenyl]methanesulfonamide; mesylic acid Formula: C12H21NO6S2 MolecularWeight: 339.42824

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NC1=CC=C(C=C1)CCCCO.CS(=O)(=O)O

Isomeric SMILES

CS(=O)(=O)NC1=CC=C(C=C1)CCCCO.CS(=O)(=O)O

InChI

InChI=1S/C11H17NO3S.CH4O3S/c1-16(14,15)12-11-7-5-10(6-8-11)4-2-3-9-13;1-5(2,3)4/h5-8,12-13H,2-4,9H2,1H3;1H3,(H,2,3,4)