2-[(2S,4S)-4-tert-butyl-2-(5-trimethylsilylpent-4-ynyl)cyclohexylidene]ethenyl 4-nitrobenzoate

Systemtic Name: 2-[(2S,4S)-4-tert-butyl-2-(5-trimethylsilylpent-4-ynyl)cyclohexylidene]ethenyl 4-nitrobenzoate Openeye Name: 2-[(2S,4S)-4-tert-butyl-2-(5-trimethylsilylpent-4-ynyl)cyclohexylidene]vinyl 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid 2-[(2S,4S)-4-tert-butyl-2-(5-trimethylsilylpent-4-ynyl)cyclohexylidene]ethenyl ester IUPAC Name: 2-[(2S,4S)-4-tert-butyl-2-(5-trimethylsilylpent-4-ynyl)cyclohexylidene]ethenyl 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid 2-[(2S,4S)-4-tert-butyl-2-(5-trimethylsilylpent-4-ynyl)cyclohexylidene]vinyl ester Formula: C27H37NO4Si MolecularWeight: 467.67248

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCC(=C=COC(=O)C2=CC=C(C=C2)[N+](=O)[O-])C(C1)CCCC#C[Si](C)(C)C

Isomeric SMILES

CC(C)(C)[C@H]1CCC(=C=COC(=O)C2=CC=C(C=C2)[N+](=O)[O-])[C@H](C1)CCCC#C[Si](C)(C)C

InChI

InChI=1S/C27H37NO4Si/c1-27(2,3)24-14-11-21(23(20-24)10-8-7-9-19-33(4,5)6)17-18-32-26(29)22-12-15-25(16-13-22)28(30)31/h12-13,15-16,18,23-24H,7-8,10-11,14,20H2,1-6H3/t17?,23-,24-/m0/s1