[(1S,4Z,8S)-8-phenylazanylcyclooct-4-en-1-yl] ethanoate

Systemtic Name: [(1S,4Z,8S)-8-phenylazanylcyclooct-4-en-1-yl] ethanoate Openeye Name: [(1S,4Z,8S)-8-anilinocyclooct-4-en-1-yl] acetate CAS Name: acetic acid [(1S,4Z,8S)-8-anilino-1-cyclooct-4-enyl] ester IUPAC Name: [(1S,4Z,8S)-8-anilinocyclooct-4-en-1-yl] acetate Traditional Name: acetic acid [(1S,4Z,8S)-8-anilinocyclooct-4-en-1-yl] ester Formula: C16H21NO2 MolecularWeight: 259.34344

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1CCC=CCCC1NC2=CC=CC=C2

Isomeric SMILES

CC(=O)O[C@H]1CC/C=C\CC[C@@H]1NC2=CC=CC=C2

InChI

InChI=1S/C16H21NO2/c1-13(18)19-16-12-8-3-2-7-11-15(16)17-14-9-5-4-6-10-14/h2-6,9-10,15-17H,7-8,11-12H2,1H3/b3-2-/t15-,16-/m0/s1