phenyl [2,3-bis(3-azanylphenoxy)phenyl]methanesulfonate

Systemtic Name: phenyl [2,3-bis(3-azanylphenoxy)phenyl]methanesulfonate Openeye Name: phenyl [2,3-bis(3-aminophenoxy)phenyl]methanesulfonate CAS Name: [2,3-bis(3-aminophenoxy)phenyl]methanesulfonic acid phenyl ester IUPAC Name: phenyl [2,3-bis(3-aminophenoxy)phenyl]methanesulfonate Traditional Name: [2,3-bis(3-aminophenoxy)phenyl]methanesulfonic acid phenyl ester Formula: C25H22N2O5S MolecularWeight: 462.51758

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OS(=O)(=O)CC2=C(C(=CC=C2)OC3=CC=CC(=C3)N)OC4=CC=CC(=C4)N

Isomeric SMILES

C1=CC=C(C=C1)OS(=O)(=O)CC2=C(C(=CC=C2)OC3=CC=CC(=C3)N)OC4=CC=CC(=C4)N

InChI

InChI=1S/C25H22N2O5S/c26-19-8-5-12-22(15-19)30-24-14-4-7-18(25(24)31-23-13-6-9-20(27)16-23)17-33(28,29)32-21-10-2-1-3-11-21/h1-16H,17,26-27H2