ditert-butyl (2S,4S,5R,8S)-5-oxidanyl-4-(3-oxidanylpropyl)-2,8-bis[(9-phenylfluoren-9-yl)amino]nonanedioate

Systemtic Name: ditert-butyl (2S,4S,5R,8S)-5-oxidanyl-4-(3-oxidanylpropyl)-2,8-bis[(9-phenylfluoren-9-yl)amino]nonanedioate Openeye Name: ditert-butyl (2S,4S,5R,8S)-5-hydroxy-4-(3-hydroxypropyl)-2,8-bis[(9-phenylfluoren-9-yl)amino]nonanedioate CAS Name: (2S,4S,5R,8S)-5-hydroxy-4-(3-hydroxypropyl)-2,8-bis[(9-phenyl-9-fluorenyl)amino]nonanedioic acid ditert-butyl ester IUPAC Name: ditert-butyl (2S,4S,5R,8S)-5-hydroxy-4-(3-hydroxypropyl)-2,8-bis[(9-phenylfluoren-9-yl)amino]nonanedioate Traditional Name: (2S,4S,5R,8S)-5-hydroxy-4-(3-hydroxypropyl)-2,8-bis[(9-phenylfluoren-9-yl)amino]azelaic acid ditert-butyl ester Formula: C58H64N2O6 MolecularWeight: 885.13856

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C58H64N2O6/c1-55(2,3)65-53(63)50(59-57(40-23-9-7-10-24-40)46-31-17-13-27-42(46)43-28-14-18-32-47(43)57)35-36-52(62)39(22-21-37-61)38-51(54(64)66-56(4,5)6)60-58(41-25-11-8-12-26-41)48-33-19-15-29-44(48)45-30-16-20-34-49(45)58/h7-20,23-34,39,50-52,59-62H,21-22,35-38H2,1-6H3/t39-,50-,51-,52+/m0/s1