methanesulfonic acid; 3-methoxy-4-(5-methoxypentoxy)aniline

Systemtic Name: methanesulfonic acid; 3-methoxy-4-(5-methoxypentoxy)aniline Openeye Name: methanesulfonic acid; 3-methoxy-4-(5-methoxypentoxy)aniline CAS Name: methanesulfonic acid; 3-methoxy-4-(5-methoxypentoxy)aniline IUPAC Name: methanesulfonic acid; 3-methoxy-4-(5-methoxypentoxy)aniline Traditional Name: mesylic acid; [3-methoxy-4-(5-methoxypentoxy)phenyl]amine Formula: C14H25NO6S MolecularWeight: 335.4164

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Descriptors Computed from Structure

Canonical SMILES:

COCCCCCOC1=C(C=C(C=C1)N)OC.CS(=O)(=O)O

Isomeric SMILES

COCCCCCOC1=C(C=C(C=C1)N)OC.CS(=O)(=O)O

InChI

InChI=1S/C13H21NO3.CH4O3S/c1-15-8-4-3-5-9-17-12-7-6-11(14)10-13(12)16-2;1-5(2,3)4/h6-7,10H,3-5,8-9,14H2,1-2H3;1H3,(H,2,3,4)