O1,O7-ditert-butyl O3-methyl (1R,7S)-4-oxidanylidene-1,7-bis[(9-phenylfluoren-9-yl)amino]heptane-1,3,7-tricarboxylate

Systemtic Name: O1,O7-ditert-butyl O3-methyl (1R,7S)-4-oxidanylidene-1,7-bis[(9-phenylfluoren-9-yl)amino]heptane-1,3,7-tricarboxylate Openeye Name: O1,O7-ditert-butyl O3-methyl (1R,7S)-4-oxo-1,7-bis[(9-phenylfluoren-9-yl)amino]heptane-1,3,7-tricarboxylate CAS Name: (1R,7S)-4-oxo-1,7-bis[(9-phenyl-9-fluorenyl)amino]heptane-1,3,7-tricarboxylic acid O1,O7-ditert-butyl ester O3-methyl ester IUPAC Name: 1-O,7-O-ditert-butyl 3-O-methyl (1R,7S)-4-oxo-1,7-bis[(9-phenylfluoren-9-yl)amino]heptane-1,3,7-tricarboxylate Traditional Name: (1R,7S)-4-keto-1,7-bis[(9-phenylfluoren-9-yl)amino]heptane-1,3,7-tricarboxylic acid O1,O7-ditert-butyl ester O3-methyl ester Formula: C57H58N2O7 MolecularWeight: 883.07962

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Descriptors Computed from Structure

Canonical SMILES:

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

InChI

InChI=1S/C57H58N2O7/c1-54(2,3)65-52(62)48(58-56(37-22-10-8-11-23-37)44-30-18-14-26-39(44)40-27-15-19-31-45(40)56)34-35-50(60)43(51(61)64-7)36-49(53(63)66-55(4,5)6)59-57(38-24-12-9-13-25-38)46-32-20-16-28-41(46)42-29-17-21-33-47(42)57/h8-33,43,48-49,58-59H,34-36H2,1-7H3/t43?,48-,49+/m0/s1