methanesulfonic acid; 4-[6-(2-methoxyphenoxy)hexoxy]benzenecarboximidamide

Systemtic Name: methanesulfonic acid; 4-[6-(2-methoxyphenoxy)hexoxy]benzenecarboximidamide Openeye Name: methanesulfonic acid; 4-[6-(2-methoxyphenoxy)hexoxy]benzamidine CAS Name: methanesulfonic acid; 4-[6-(2-methoxyphenoxy)hexoxy]benzenecarboximidamide IUPAC Name: methanesulfonic acid; 4-[6-(2-methoxyphenoxy)hexoxy]benzenecarboximidamide Traditional Name: mesylic acid; 4-[6-(2-methoxyphenoxy)hexoxy]benzamidine Formula: C21H30N2O6S MolecularWeight: 438.5377

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1OCCCCCCOC2=CC=C(C=C2)C(=N)N.CS(=O)(=O)O

Isomeric SMILES

COC1=CC=CC=C1OCCCCCCOC2=CC=C(C=C2)C(=N)N.CS(=O)(=O)O

InChI

InChI=1S/C20H26N2O3.CH4O3S/c1-23-18-8-4-5-9-19(18)25-15-7-3-2-6-14-24-17-12-10-16(11-13-17)20(21)22;1-5(2,3)4/h4-5,8-13H,2-3,6-7,14-15H2,1H3,(H3,21,22);1H3,(H,2,3,4)