tert-butyl (E,2S)-7,7-dimethyl-6-oxidanylidene-2-[(9-phenylfluoren-9-yl)amino]oct-4-enoate

Systemtic Name: tert-butyl (E,2S)-7,7-dimethyl-6-oxidanylidene-2-[(9-phenylfluoren-9-yl)amino]oct-4-enoate Openeye Name: tert-butyl (E,2S)-7,7-dimethyl-6-oxo-2-[(9-phenylfluoren-9-yl)amino]oct-4-enoate CAS Name: (E,2S)-7,7-dimethyl-6-oxo-2-[(9-phenyl-9-fluorenyl)amino]-4-octenoic acid tert-butyl ester IUPAC Name: tert-butyl (E,2S)-7,7-dimethyl-6-oxo-2-[(9-phenylfluoren-9-yl)amino]oct-4-enoate Traditional Name: (E,2S)-6-keto-7,7-dimethyl-2-[(9-phenylfluoren-9-yl)amino]oct-4-enoic acid tert-butyl ester Formula: C33H37NO3 MolecularWeight: 495.65178

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)C=CCC(C(=O)OC(C)(C)C)NC1(C2=CC=CC=C2C3=CC=CC=C31)C4=CC=CC=C4

Isomeric SMILES

CC(C)(C)C(=O)/C=C/C[C@@H](C(=O)OC(C)(C)C)NC1(C2=CC=CC=C2C3=CC=CC=C31)C4=CC=CC=C4

InChI

InChI=1S/C33H37NO3/c1-31(2,3)29(35)22-14-21-28(30(36)37-32(4,5)6)34-33(23-15-8-7-9-16-23)26-19-12-10-17-24(26)25-18-11-13-20-27(25)33/h7-20,22,28,34H,21H2,1-6H3/b22-14+/t28-/m0/s1