ethyl 5-azanyl-2-[bis(fluoranyl)methyl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]pent-3-ynoate

Systemtic Name: ethyl 5-azanyl-2-[bis(fluoranyl)methyl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]pent-3-ynoate Openeye Name: ethyl 5-amino-2-(tert-butoxycarbonylamino)-2-(difluoromethyl)pent-3-ynoate CAS Name: 5-amino-2-(difluoromethyl)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-pentynoic acid ethyl ester IUPAC Name: ethyl 5-amino-2-(difluoromethyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]pent-3-ynoate Traditional Name: 5-amino-2-(tert-butoxycarbonylamino)-2-(difluoromethyl)pent-3-ynoic acid ethyl ester Formula: C13H20F2N2O4 MolecularWeight: 306.305706

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C#CCN)(C(F)F)NC(=O)OC(C)(C)C

Isomeric SMILES

CCOC(=O)C(C#CCN)(C(F)F)NC(=O)OC(C)(C)C

InChI

InChI=1S/C13H20F2N2O4/c1-5-20-10(18)13(9(14)15,7-6-8-16)17-11(19)21-12(2,3)4/h9H,5,8,16H2,1-4H3,(H,17,19)