tert-butyl (1S,2S,3S)-2-heptyl-3-phenacyl-cyclopropane-1-carboxylate

Systemtic Name: tert-butyl (1S,2S,3S)-2-heptyl-3-phenacyl-cyclopropane-1-carboxylate Openeye Name: tert-butyl (1S,2S,3S)-2-heptyl-3-phenacyl-cyclopropanecarboxylate CAS Name: (1S,2S,3S)-2-heptyl-3-phenacyl-1-cyclopropanecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (1S,2S,3S)-2-heptyl-3-phenacylcyclopropane-1-carboxylate Traditional Name: (1S,2S,3S)-2-heptyl-3-phenacyl-cyclopropanecarboxylic acid tert-butyl ester Formula: C23H34O3 MolecularWeight: 358.51426

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1C(C1C(=O)OC(C)(C)C)CC(=O)C2=CC=CC=C2

Isomeric SMILES

CCCCCCC[C@H]1[C@@H]([C@H]1C(=O)OC(C)(C)C)CC(=O)C2=CC=CC=C2

InChI

InChI=1S/C23H34O3/c1-5-6-7-8-12-15-18-19(21(18)22(25)26-23(2,3)4)16-20(24)17-13-10-9-11-14-17/h9-11,13-14,18-19,21H,5-8,12,15-16H2,1-4H3/t18-,19-,21-/m0/s1