[3-[2-[4-(4-carbamimidoylphenyl)-2-propyl-phenoxy]ethoxy]phenyl] hydrogen sulfate

Systemtic Name: [3-[2-[4-(4-carbamimidoylphenyl)-2-propyl-phenoxy]ethoxy]phenyl] hydrogen sulfate Openeye Name: [3-[2-[4-(4-carbamimidoylphenyl)-2-propyl-phenoxy]ethoxy]phenyl] hydrogen sulfate CAS Name: sulfuric acid [3-[2-[4-(4-carbamimidoylphenyl)-2-propylphenoxy]ethoxy]phenyl] ester IUPAC Name: [3-[2-[4-(4-carbamimidoylphenyl)-2-propylphenoxy]ethoxy]phenyl] hydrogen sulfate Traditional Name: sulfuric acid [3-[2-[4-(4-amidinophenyl)-2-propyl-phenoxy]ethoxy]phenyl] ester Formula: C24H26N2O6S MolecularWeight: 470.53804

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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=C3)OS(=O)(=O)O

Isomeric SMILES

CCCC1=C(C=CC(=C1)C2=CC=C(C=C2)C(=N)N)OCCOC3=CC(=CC=C3)OS(=O)(=O)O

InChI

InChI=1S/C24H26N2O6S/c1-2-4-20-15-19(17-7-9-18(10-8-17)24(25)26)11-12-23(20)31-14-13-30-21-5-3-6-22(16-21)32-33(27,28)29/h3,5-12,15-16H,2,4,13-14H2,1H3,(H3,25,26)(H,27,28,29)