[3-(aminocarbonylamino)-2-cycloheptylcarbonyl-1-benzofuran-6-yl] methanesulfonate

Systemtic Name: [3-(aminocarbonylamino)-2-cycloheptylcarbonyl-1-benzofuran-6-yl] methanesulfonate Openeye Name: [2-(cycloheptanecarbonyl)-3-ureido-benzofuran-6-yl] methanesulfonate CAS Name: methanesulfonic acid [3-(carbamoylamino)-2-[cycloheptyl(oxo)methyl]-6-benzofuranyl] ester IUPAC Name: [3-(carbamoylamino)-2-(cycloheptanecarbonyl)-1-benzofuran-6-yl] methanesulfonate Traditional Name: methanesulfonic acid [2-(cycloheptanecarbonyl)-3-ureido-benzofuran-6-yl] ester Formula: C18H22N2O6S MolecularWeight: 394.44208

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OC1=CC2=C(C=C1)C(=C(O2)C(=O)C3CCCCCC3)NC(=O)N

Isomeric SMILES

CS(=O)(=O)OC1=CC2=C(C=C1)C(=C(O2)C(=O)C3CCCCCC3)NC(=O)N

InChI

InChI=1S/C18H22N2O6S/c1-27(23,24)26-12-8-9-13-14(10-12)25-17(15(13)20-18(19)22)16(21)11-6-4-2-3-5-7-11/h8-11H,2-7H2,1H3,(H3,19,20,22)