O1-tert-butyl O10-(phenylmethyl) (E,2S,9S)-9-[(2-methylpropan-2-yl)oxycarbonylamino]-6-oxidanylidene-2-[(9-phenylfluoren-9-yl)amino]dec-4-enedioate

Systemtic Name: O1-tert-butyl O10-(phenylmethyl) (E,2S,9S)-9-[(2-methylpropan-2-yl)oxycarbonylamino]-6-oxidanylidene-2-[(9-phenylfluoren-9-yl)amino]dec-4-enedioate Openeye Name: O10-benzyl O1-tert-butyl (E,2S,9S)-9-(tert-butoxycarbonylamino)-6-oxo-2-[(9-phenylfluoren-9-yl)amino]dec-4-enedioate CAS Name: (E,2S,9S)-9-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-6-oxo-2-[(9-phenyl-9-fluorenyl)amino]-4-decenedioic acid O1-tert-butyl ester O10-(phenylmethyl) ester IUPAC Name: 10-O-benzyl 1-O-tert-butyl (E,2S,9S)-9-[(2-methylpropan-2-yl)oxycarbonylamino]-6-oxo-2-[(9-phenylfluoren-9-yl)amino]dec-4-enedioate Traditional Name: (E,2S,9S)-9-(tert-butoxycarbonylamino)-6-keto-2-[(9-phenylfluoren-9-yl)amino]dec-4-enedioic acid O10-benzyl ester O1-tert-butyl ester Formula: C45H50N2O7 MolecularWeight: 730.8877

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(CC=CC(=O)CCC(C(=O)OCC1=CC=CC=C1)NC(=O)OC(C)(C)C)NC2(C3=CC=CC=C3C4=CC=CC=C42)C5=CC=CC=C5

Isomeric SMILES

CC(C)(C)OC(=O)[C@H](C/C=C/C(=O)CC[C@@H](C(=O)OCC1=CC=CC=C1)NC(=O)OC(C)(C)C)NC2(C3=CC=CC=C3C4=CC=CC=C42)C5=CC=CC=C5

InChI

InChI=1S/C45H50N2O7/c1-43(2,3)53-41(50)39(47-45(32-20-11-8-12-21-32)36-25-15-13-23-34(36)35-24-14-16-26-37(35)45)27-17-22-33(48)28-29-38(46-42(51)54-44(4,5)6)40(49)52-30-31-18-9-7-10-19-31/h7-26,38-39,47H,27-30H2,1-6H3,(H,46,51)/b22-17+/t38-,39-/m0/s1