(phenylmethyl) (3R,8E)-12-oxidanylidene-3-(trifluoromethyl)-1-oxa-4-azacyclododec-8-ene-4-carboxylate

Systemtic Name: (phenylmethyl) (3R,8E)-12-oxidanylidene-3-(trifluoromethyl)-1-oxa-4-azacyclododec-8-ene-4-carboxylate Openeye Name: benzyl (3R,8E)-12-oxo-3-(trifluoromethyl)-1-oxa-4-azacyclododec-8-ene-4-carboxylate CAS Name: (3R,8E)-12-oxo-3-(trifluoromethyl)-1-oxa-4-azacyclododec-8-ene-4-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl (3R,8E)-12-oxo-3-(trifluoromethyl)-1-oxa-4-azacyclododec-8-ene-4-carboxylate Traditional Name: (3R,8E)-12-keto-3-(trifluoromethyl)-1-oxa-4-azacyclododec-8-ene-4-carboxylic acid benzyl ester Formula: C19H22F3NO4 MolecularWeight: 385.37749

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Descriptors Computed from Structure

Canonical SMILES:

C1CC=CCCC(=O)OCC(N(C1)C(=O)OCC2=CC=CC=C2)C(F)(F)F

Isomeric SMILES

C1C/C=C/CCC(=O)OC[C@@H](N(C1)C(=O)OCC2=CC=CC=C2)C(F)(F)F

InChI

InChI=1S/C19H22F3NO4/c20-19(21,22)16-14-26-17(24)11-7-2-1-3-8-12-23(16)18(25)27-13-15-9-5-4-6-10-15/h1-2,4-6,9-10,16H,3,7-8,11-14H2/b2-1+/t16-/m1/s1