4-[2-(3-azanylphenoxy)ethoxy]benzenecarboximidamide; benzenesulfonic acid

Systemtic Name: 4-[2-(3-azanylphenoxy)ethoxy]benzenecarboximidamide; benzenesulfonic acid Openeye Name: 4-[2-(3-aminophenoxy)ethoxy]benzamidine; benzenesulfonic acid CAS Name: 4-[2-(3-aminophenoxy)ethoxy]benzenecarboximidamide; benzenesulfonic acid IUPAC Name: 4-[2-(3-aminophenoxy)ethoxy]benzenecarboximidamide; benzenesulfonic acid Traditional Name: 4-[2-(3-aminophenoxy)ethoxy]benzamidine; besylic acid Formula: C21H23N3O5S MolecularWeight: 429.48942

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)O.C1=CC(=CC(=C1)OCCOC2=CC=C(C=C2)C(=N)N)N

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)O.C1=CC(=CC(=C1)OCCOC2=CC=C(C=C2)C(=N)N)N

InChI

InChI=1S/C15H17N3O2.C6H6O3S/c16-12-2-1-3-14(10-12)20-9-8-19-13-6-4-11(5-7-13)15(17)18;7-10(8,9)6-4-2-1-3-5-6/h1-7,10H,8-9,16H2,(H3,17,18);1-5H,(H,7,8,9)