[2-[carbamimidoyl(propoxy)amino]oxyphenyl] benzenesulfonate dihydrochloride

Systemtic Name: [2-[carbamimidoyl(propoxy)amino]oxyphenyl] benzenesulfonate dihydrochloride Openeye Name: [2-[carbamimidoyl(propoxy)amino]oxyphenyl] benzenesulfonate dihydrochloride CAS Name: benzenesulfonic acid [2-[carbamimidoyl(propoxy)amino]oxyphenyl] ester dihydrochloride IUPAC Name: [2-[carbamimidoyl(propoxy)amino]oxyphenyl] benzenesulfonate dihydrochloride Traditional Name: benzenesulfonic acid [2-[amidino(propoxy)amino]oxyphenyl] ester dihydrochloride Formula: C16H21Cl2N3O5S MolecularWeight: 438.32604

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Descriptors Computed from Structure

Canonical SMILES:

CCCON(C(=N)N)OC1=CC=CC=C1OS(=O)(=O)C2=CC=CC=C2.Cl.Cl

Isomeric SMILES

CCCON(C(=N)N)OC1=CC=CC=C1OS(=O)(=O)C2=CC=CC=C2.Cl.Cl

InChI

InChI=1S/C16H19N3O5S.2ClH/c1-2-12-22-19(16(17)18)23-14-10-6-7-11-15(14)24-25(20,21)13-8-4-3-5-9-13;;/h3-11H,2,12H2,1H3,(H3,17,18);2*1H