4-[5-(2,3-dimethoxyphenoxy)pentoxy]benzenecarboximidamide; methanesulfonic acid

Systemtic Name: 4-[5-(2,3-dimethoxyphenoxy)pentoxy]benzenecarboximidamide; methanesulfonic acid Openeye Name: 4-[5-(2,3-dimethoxyphenoxy)pentoxy]benzamidine; methanesulfonic acid CAS Name: 4-[5-(2,3-dimethoxyphenoxy)pentoxy]benzenecarboximidamide; methanesulfonic acid IUPAC Name: 4-[5-(2,3-dimethoxyphenoxy)pentoxy]benzenecarboximidamide; methanesulfonic acid Traditional Name: 4-[5-(2,3-dimethoxyphenoxy)pentoxy]benzamidine; mesylic acid Formula: C21H30N2O7S MolecularWeight: 454.5371

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC=C1)OCCCCCOC2=CC=C(C=C2)C(=N)N)OC.CS(=O)(=O)O

Isomeric SMILES

COC1=C(C(=CC=C1)OCCCCCOC2=CC=C(C=C2)C(=N)N)OC.CS(=O)(=O)O

InChI

InChI=1S/C20H26N2O4.CH4O3S/c1-23-17-7-6-8-18(19(17)24-2)26-14-5-3-4-13-25-16-11-9-15(10-12-16)20(21)22;1-5(2,3)4/h6-12H,3-5,13-14H2,1-2H3,(H3,21,22);1H3,(H,2,3,4)