4-[3-(4-carbamimidoylphenoxy)propoxy]benzenecarboximidamide; 2-oxidanylethanesulfonic acid

Systemtic Name: 4-[3-(4-carbamimidoylphenoxy)propoxy]benzenecarboximidamide; 2-oxidanylethanesulfonic acid Openeye Name: 4-[3-(4-carbamimidoylphenoxy)propoxy]benzamidine; 2-hydroxyethanesulfonic acid CAS Name: 4-[3-(4-carbamimidoylphenoxy)propoxy]benzenecarboximidamide; 2-hydroxyethanesulfonic acid IUPAC Name: 4-[3-(4-carbamimidoylphenoxy)propoxy]benzenecarboximidamide; 2-hydroxyethanesulfonic acid Traditional Name: 4-[3-(4-amidinophenoxy)propoxy]benzamidine; 2-hydroxyethanesulfonic acid Formula: C21H32N4O10S2 MolecularWeight: 564.62958

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=N)N)OCCCOC2=CC=C(C=C2)C(=N)N.C(CS(=O)(=O)O)O.C(CS(=O)(=O)O)O

Isomeric SMILES

C1=CC(=CC=C1C(=N)N)OCCCOC2=CC=C(C=C2)C(=N)N.C(CS(=O)(=O)O)O.C(CS(=O)(=O)O)O

InChI

InChI=1S/C17H20N4O2.2C2H6O4S/c18-16(19)12-2-6-14(7-3-12)22-10-1-11-23-15-8-4-13(5-9-15)17(20)21;2*3-1-2-7(4,5)6/h2-9H,1,10-11H2,(H3,18,19)(H3,20,21);2*3H,1-2H2,(H,4,5,6)