undecyl 3-acetamido-4-[bis(azanyl)methylideneamino]-2-[1-fluoranyl-2,3-bis(oxidanyl)propyl]-3,4-dihydro-2H-pyran-6-carboxylate

Systemtic Name: undecyl 3-acetamido-4-[bis(azanyl)methylideneamino]-2-[1-fluoranyl-2,3-bis(oxidanyl)propyl]-3,4-dihydro-2H-pyran-6-carboxylate Openeye Name: undecyl 3-acetamido-2-(1-fluoro-2,3-dihydroxy-propyl)-4-guanidino-3,4-dihydro-2H-pyran-6-carboxylate CAS Name: 3-acetamido-4-(diaminomethylideneamino)-2-(1-fluoro-2,3-dihydroxypropyl)-3,4-dihydro-2H-pyran-6-carboxylic acid undecyl ester IUPAC Name: undecyl 3-acetamido-4-(diaminomethylideneamino)-2-(1-fluoro-2,3-dihydroxypropyl)-3,4-dihydro-2H-pyran-6-carboxylate Traditional Name: 3-acetamido-2-(1-fluoro-2,3-dihydroxy-propyl)-4-guanidino-3,4-dihydro-2H-pyran-6-carboxylic acid undecyl ester Formula: C23H41FN4O6 MolecularWeight: 488.593243

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCOC(=O)C1=CC(C(C(O1)C(C(CO)O)F)NC(=O)C)N=C(N)N

Isomeric SMILES

CCCCCCCCCCCOC(=O)C1=CC(C(C(O1)C(C(CO)O)F)NC(=O)C)N=C(N)N

InChI

InChI=1S/C23H41FN4O6/c1-3-4-5-6-7-8-9-10-11-12-33-22(32)18-13-16(28-23(25)26)20(27-15(2)30)21(34-18)19(24)17(31)14-29/h13,16-17,19-21,29,31H,3-12,14H2,1-2H3,(H,27,30)(H4,25,26,28)