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

Systemtic Name: [(1S)-2-ethoxy-2-oxidanylidene-1-[(4S)-2-oxidanylidene-4-[(1S)-2-oxidanylidenecycloheptyl]azetidin-1-yl]ethyl] benzoate Openeye Name: [(1S)-2-ethoxy-2-oxo-1-[(4S)-2-oxo-4-[(1S)-2-oxocycloheptyl]azetidin-1-yl]ethyl] benzoate CAS Name: benzoic acid [(1S)-2-ethoxy-2-oxo-1-[(4S)-2-oxo-4-[(1S)-2-oxocycloheptyl]-1-azetidinyl]ethyl] ester IUPAC Name: [(1S)-2-ethoxy-2-oxo-1-[(4S)-2-oxo-4-[(1S)-2-oxocycloheptyl]azetidin-1-yl]ethyl] benzoate Traditional Name: benzoic acid [(1S)-2-ethoxy-2-keto-1-[(4S)-2-keto-4-[(1S)-2-ketocycloheptyl]azetidin-1-yl]ethyl] ester Formula: C21H25NO6 MolecularWeight: 387.4263

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(N1C(CC1=O)C2CCCCCC2=O)OC(=O)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)[C@@H](N1[C@@H](CC1=O)[C@@H]2CCCCCC2=O)OC(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H25NO6/c1-2-27-21(26)19(28-20(25)14-9-5-3-6-10-14)22-16(13-18(22)24)15-11-7-4-8-12-17(15)23/h3,5-6,9-10,15-16,19H,2,4,7-8,11-13H2,1H3/t15-,16-,19-/m0/s1