methanesulfonic acid; 4-[4-[2-(3-methoxy-2-propyl-phenoxy)ethoxy]-3-propyl-phenyl]benzenecarboximidamide

Systemtic Name: methanesulfonic acid; 4-[4-[2-(3-methoxy-2-propyl-phenoxy)ethoxy]-3-propyl-phenyl]benzenecarboximidamide Openeye Name: methanesulfonic acid; 4-[4-[2-(3-methoxy-2-propyl-phenoxy)ethoxy]-3-propyl-phenyl]benzamidine CAS Name: methanesulfonic acid; 4-[4-[2-(3-methoxy-2-propylphenoxy)ethoxy]-3-propylphenyl]benzenecarboximidamide IUPAC Name: methanesulfonic acid; 4-[4-[2-(3-methoxy-2-propylphenoxy)ethoxy]-3-propylphenyl]benzenecarboximidamide Traditional Name: mesylic acid; 4-[4-[2-(3-methoxy-2-propyl-phenoxy)ethoxy]-3-propyl-phenyl]benzamidine Formula: C29H38N2O6S MolecularWeight: 542.68682

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1)C2=CC=C(C=C2)C(=N)N)OCCOC3=CC=CC(=C3CCC)OC.CS(=O)(=O)O

Isomeric SMILES

CCCC1=C(C=CC(=C1)C2=CC=C(C=C2)C(=N)N)OCCOC3=CC=CC(=C3CCC)OC.CS(=O)(=O)O

InChI

InChI=1S/C28H34N2O3.CH4O3S/c1-4-7-23-19-22(20-11-13-21(14-12-20)28(29)30)15-16-25(23)32-17-18-33-27-10-6-9-26(31-3)24(27)8-5-2;1-5(2,3)4/h6,9-16,19H,4-5,7-8,17-18H2,1-3H3,(H3,29,30);1H3,(H,2,3,4)