[(3Z,6S,7E)-13-trimethylsilyltrideca-3,7-dien-9,12-diyn-6-yl] benzoate

Systemtic Name: [(3Z,6S,7E)-13-trimethylsilyltrideca-3,7-dien-9,12-diyn-6-yl] benzoate Openeye Name: [(E,1S)-1-[(Z)-pent-2-enyl]-8-trimethylsilyl-oct-2-en-4,7-diynyl] benzoate CAS Name: benzoic acid [(3Z,6S,7E)-13-trimethylsilyltrideca-3,7-dien-9,12-diyn-6-yl] ester IUPAC Name: [(3Z,6S,7E)-13-trimethylsilyltrideca-3,7-dien-9,12-diyn-6-yl] benzoate Traditional Name: benzoic acid [(E,1S)-1-[(Z)-pent-2-enyl]-8-trimethylsilyl-oct-2-en-4,7-diynyl] ester Formula: C23H28O2Si MolecularWeight: 364.55272

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Descriptors Computed from Structure

Canonical SMILES:

CCC=CCC(C=CC#CCC#C[Si](C)(C)C)OC(=O)C1=CC=CC=C1

Isomeric SMILES

CC/C=C\C[C@@H](/C=C/C#CCC#C[Si](C)(C)C)OC(=O)C1=CC=CC=C1

InChI

InChI=1S/C23H28O2Si/c1-5-6-11-18-22(25-23(24)21-16-12-10-13-17-21)19-14-8-7-9-15-20-26(2,3)4/h6,10-14,16-17,19,22H,5,9,18H2,1-4H3/b11-6-,19-14+/t22-/m0/s1