cyclohexyl 2-[(5-carbamimidoyl-1-benzofuran-2-yl)carbonylamino]ethaneperoxoate

Systemtic Name: cyclohexyl 2-[(5-carbamimidoyl-1-benzofuran-2-yl)carbonylamino]ethaneperoxoate Openeye Name: cyclohexyl 2-[(5-carbamimidoylbenzofuran-2-carbonyl)amino]peroxyacetate CAS Name: 2-[[(5-carbamimidoyl-2-benzofuranyl)-oxomethyl]amino]ethaneperoxoic acid cyclohexyl ester IUPAC Name: cyclohexyl 2-[(5-carbamimidoyl-1-benzofuran-2-carbonyl)amino]ethaneperoxoate Traditional Name: 2-[(5-amidinobenzofuran-2-carbonyl)amino]peracetic acid cyclohexyl ester Formula: C18H21N3O5 MolecularWeight: 359.37644

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)OOC(=O)CNC(=O)C2=CC3=C(O2)C=CC(=C3)C(=N)N

Isomeric SMILES

C1CCC(CC1)OOC(=O)CNC(=O)C2=CC3=C(O2)C=CC(=C3)C(=N)N

InChI

InChI=1S/C18H21N3O5/c19-17(20)11-6-7-14-12(8-11)9-15(24-14)18(23)21-10-16(22)26-25-13-4-2-1-3-5-13/h6-9,13H,1-5,10H2,(H3,19,20)(H,21,23)