[(1S)-2-ethoxy-2-oxidanylidene-1-[(4S)-2-oxidanylidene-4-[(1S)-2-oxidanylidenecyclooctyl]azetidin-1-yl]ethyl] benzoate

Systemtic Name: [(1S)-2-ethoxy-2-oxidanylidene-1-[(4S)-2-oxidanylidene-4-[(1S)-2-oxidanylidenecyclooctyl]azetidin-1-yl]ethyl] benzoate Openeye Name: [(1S)-2-ethoxy-2-oxo-1-[(4S)-2-oxo-4-[(1S)-2-oxocyclooctyl]azetidin-1-yl]ethyl] benzoate CAS Name: benzoic acid [(1S)-2-ethoxy-2-oxo-1-[(4S)-2-oxo-4-[(1S)-2-oxocyclooctyl]-1-azetidinyl]ethyl] ester IUPAC Name: [(1S)-2-ethoxy-2-oxo-1-[(4S)-2-oxo-4-[(1S)-2-oxocyclooctyl]azetidin-1-yl]ethyl] benzoate Traditional Name: benzoic acid [(1S)-2-ethoxy-2-keto-1-[(4S)-2-keto-4-[(1S)-2-ketocyclooctyl]azetidin-1-yl]ethyl] ester Formula: C22H27NO6 MolecularWeight: 401.45288

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(N1C(CC1=O)C2CCCCCCC2=O)OC(=O)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)[C@@H](N1[C@@H](CC1=O)[C@@H]2CCCCCCC2=O)OC(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H27NO6/c1-2-28-22(27)20(29-21(26)15-10-6-5-7-11-15)23-17(14-19(23)25)16-12-8-3-4-9-13-18(16)24/h5-7,10-11,16-17,20H,2-4,8-9,12-14H2,1H3/t16-,17-,20-/m0/s1