bis(azanyl)methylidene-[4-[[1-[2-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxidanylidene-4-phenylmethoxy-butanoyl]pyrrolidin-2-yl]carbonylamino]-5-oxidanyl-5-oxidanylidene-pentyl]azanium; 2,2,2-tris(fluoranyl)ethanoate

Systemtic Name: bis(azanyl)methylidene-[4-[[1-[2-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxidanylidene-4-phenylmethoxy-butanoyl]pyrrolidin-2-yl]carbonylamino]-5-oxidanyl-5-oxidanylidene-pentyl]azanium; 2,2,2-tris(fluoranyl)ethanoate Openeye Name: [4-[[1-[4-benzyloxy-2-(tert-butoxycarbonylamino)-4-oxo-butanoyl]pyrrolidine-2-carbonyl]amino]-5-hydroxy-5-oxo-pentyl]-(diaminomethylene)ammonium; 2,2,2-trifluoroacetate CAS Name: diaminomethylidene-[5-hydroxy-4-[[[1-[2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1,4-dioxo-4-phenylmethoxybutyl]-2-pyrrolidinyl]-oxomethyl]amino]-5-oxopentyl]ammonium; 2,2,2-trifluoroacetate IUPAC Name: diaminomethylidene-[5-hydroxy-4-[[1-[2-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxo-4-phenylmethoxybutanoyl]pyrrolidine-2-carbonyl]amino]-5-oxopentyl]azanium; 2,2,2-trifluoroacetate Traditional Name: [4-[[1-[4-benzoxy-2-(tert-butoxycarbonylamino)-4-keto-butanoyl]prolyl]amino]-5-hydroxy-5-keto-pentyl]-(diaminomethylene)ammonium; 2,2,2-trifluoroacetate Formula: C29H41F3N6O10 MolecularWeight: 690.66525

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC(=O)OCC1=CC=CC=C1)C(=O)N2CCCC2C(=O)NC(CCC[NH+]=C(N)N)C(=O)O.C(=O)(C(F)(F)F)[O-]

Isomeric SMILES

CC(C)(C)OC(=O)NC(CC(=O)OCC1=CC=CC=C1)C(=O)N2CCCC2C(=O)NC(CCC[NH+]=C(N)N)C(=O)O.C(=O)(C(F)(F)F)[O-]

InChI

InChI=1S/C27H40N6O8.C2HF3O2/c1-27(2,3)41-26(39)32-19(15-21(34)40-16-17-9-5-4-6-10-17)23(36)33-14-8-12-20(33)22(35)31-18(24(37)38)11-7-13-30-25(28)29;3-2(4,5)1(6)7/h4-6,9-10,18-20H,7-8,11-16H2,1-3H3,(H,31,35)(H,32,39)(H,37,38)(H4,28,29,30);(H,6,7)