[3-methoxy-4-[6-(methoxycarbonylamino)-1H-benzimidazol-2-yl]phenyl] methanesulfonate

Systemtic Name: [3-methoxy-4-[6-(methoxycarbonylamino)-1H-benzimidazol-2-yl]phenyl] methanesulfonate Openeye Name: [3-methoxy-4-[6-(methoxycarbonylamino)-1H-benzimidazol-2-yl]phenyl] methanesulfonate CAS Name: methanesulfonic acid [3-methoxy-4-[6-(methoxycarbonylamino)-1H-benzimidazol-2-yl]phenyl] ester IUPAC Name: [3-methoxy-4-[6-(methoxycarbonylamino)-1H-benzimidazol-2-yl]phenyl] methanesulfonate Traditional Name: methanesulfonic acid [4-[6-(carbomethoxyamino)-1H-benzimidazol-2-yl]-3-methoxy-phenyl] ester Formula: C17H17N3O6S MolecularWeight: 391.39838

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)OS(=O)(=O)C)C2=NC3=C(N2)C=C(C=C3)NC(=O)OC

Isomeric SMILES

COC1=C(C=CC(=C1)OS(=O)(=O)C)C2=NC3=C(N2)C=C(C=C3)NC(=O)OC

InChI

InChI=1S/C17H17N3O6S/c1-24-15-9-11(26-27(3,22)23)5-6-12(15)16-19-13-7-4-10(8-14(13)20-16)18-17(21)25-2/h4-9H,1-3H3,(H,18,21)(H,19,20)