ditert-butyl (E,2S,9S)-6-oxidanylidene-2,9-bis[(9-phenylfluoren-9-yl)amino]dec-4-enedioate

Systemtic Name: ditert-butyl (E,2S,9S)-6-oxidanylidene-2,9-bis[(9-phenylfluoren-9-yl)amino]dec-4-enedioate Openeye Name: ditert-butyl (E,2S,9S)-6-oxo-2,9-bis[(9-phenylfluoren-9-yl)amino]dec-4-enedioate CAS Name: (E,2S,9S)-6-oxo-2,9-bis[(9-phenyl-9-fluorenyl)amino]-4-decenedioic acid ditert-butyl ester IUPAC Name: ditert-butyl (E,2S,9S)-6-oxo-2,9-bis[(9-phenylfluoren-9-yl)amino]dec-4-enedioate Traditional Name: (E,2S,9S)-6-keto-2,9-bis[(9-phenylfluoren-9-yl)amino]dec-4-enedioic acid ditert-butyl ester Formula: C56H56N2O5 MolecularWeight: 837.05424

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(CCC(=O)C=CCC(C(=O)OC(C)(C)C)NC1(C2=CC=CC=C2C3=CC=CC=C31)C4=CC=CC=C4)NC5(C6=CC=CC=C6C7=CC=CC=C75)C8=CC=CC=C8

Isomeric SMILES

CC(C)(C)OC(=O)[C@H](CCC(=O)/C=C/C[C@@H](C(=O)OC(C)(C)C)NC1(C2=CC=CC=C2C3=CC=CC=C31)C4=CC=CC=C4)NC5(C6=CC=CC=C6C7=CC=CC=C75)C8=CC=CC=C8

InChI

InChI=1S/C56H56N2O5/c1-53(2,3)62-51(60)49(57-55(38-22-9-7-10-23-38)45-31-17-13-27-41(45)42-28-14-18-32-46(42)55)35-21-26-40(59)36-37-50(52(61)63-54(4,5)6)58-56(39-24-11-8-12-25-39)47-33-19-15-29-43(47)44-30-16-20-34-48(44)56/h7-34,49-50,57-58H,35-37H2,1-6H3/b26-21+/t49-,50-/m0/s1