[2,3,4,5,6-pentakis(fluoranyl)phenyl] (2R)-4-methyl-2-[(2-methylpropan-2-yl)oxycarbonyl-[4-(phenylmethoxycarbonylamino)butyl]amino]pentanoate

Systemtic Name: [2,3,4,5,6-pentakis(fluoranyl)phenyl] (2R)-4-methyl-2-[(2-methylpropan-2-yl)oxycarbonyl-[4-(phenylmethoxycarbonylamino)butyl]amino]pentanoate Openeye Name: (2,3,4,5,6-pentafluorophenyl) (2R)-2-[4-(benzyloxycarbonylamino)butyl-tert-butoxycarbonyl-amino]-4-methyl-pentanoate CAS Name: (2R)-4-methyl-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]-[4-(phenylmethoxycarbonylamino)butyl]amino]pentanoic acid (2,3,4,5,6-pentafluorophenyl) ester IUPAC Name: (2,3,4,5,6-pentafluorophenyl) (2R)-4-methyl-2-[(2-methylpropan-2-yl)oxycarbonyl-[4-(phenylmethoxycarbonylamino)butyl]amino]pentanoate Traditional Name: (2R)-2-[4-(benzyloxycarbonylamino)butyl-tert-butoxycarbonyl-amino]-4-methyl-valeric acid (2,3,4,5,6-pentafluorophenyl) ester Formula: C29H35F5N2O6 MolecularWeight: 602.590016

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)OC1=C(C(=C(C(=C1F)F)F)F)F)N(CCCCNC(=O)OCC2=CC=CC=C2)C(=O)OC(C)(C)C

Isomeric SMILES

CC(C)C[C@H](C(=O)OC1=C(C(=C(C(=C1F)F)F)F)F)N(CCCCNC(=O)OCC2=CC=CC=C2)C(=O)OC(C)(C)C

InChI

InChI=1S/C29H35F5N2O6/c1-17(2)15-19(26(37)41-25-23(33)21(31)20(30)22(32)24(25)34)36(28(39)42-29(3,4)5)14-10-9-13-35-27(38)40-16-18-11-7-6-8-12-18/h6-8,11-12,17,19H,9-10,13-16H2,1-5H3,(H,35,38)/t19-/m1/s1