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

Systemtic Name: methyl 2-[bis(fluoranyl)methyl]-5-[bis[(2-methylpropan-2-yl)oxycarbonylamino]methylideneamino]-2-(phenylmethoxycarbonylamino)pent-3-ynoate Openeye Name: methyl 2-(benzyloxycarbonylamino)-5-[bis(tert-butoxycarbonylamino)methyleneamino]-2-(difluoromethyl)pent-3-ynoate CAS Name: 5-[bis[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]methylideneamino]-2-(difluoromethyl)-2-(phenylmethoxycarbonylamino)-3-pentynoic acid methyl ester IUPAC Name: methyl 5-[bis[(2-methylpropan-2-yl)oxycarbonylamino]methylideneamino]-2-(difluoromethyl)-2-(phenylmethoxycarbonylamino)pent-3-ynoate Traditional Name: 2-(benzyloxycarbonylamino)-5-[bis(tert-butoxycarbonylamino)methyleneamino]-2-(difluoromethyl)pent-3-ynoic acid methyl ester Formula: C26H34F2N4O8 MolecularWeight: 568.566966

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(=NCC#CC(C(F)F)(C(=O)OC)NC(=O)OCC1=CC=CC=C1)NC(=O)OC(C)(C)C

Isomeric SMILES

CC(C)(C)OC(=O)NC(=NCC#CC(C(F)F)(C(=O)OC)NC(=O)OCC1=CC=CC=C1)NC(=O)OC(C)(C)C

InChI

InChI=1S/C26H34F2N4O8/c1-24(2,3)39-21(34)30-20(31-22(35)40-25(4,5)6)29-15-11-14-26(18(27)28,19(33)37-7)32-23(36)38-16-17-12-9-8-10-13-17/h8-10,12-13,18H,15-16H2,1-7H3,(H,32,36)(H2,29,30,31,34,35)