(4Z)-N-[2-(2-hydroxyethylamino)ethyl]-4-phenethylidene-2-(trifluoromethyl)oxepane-2-carboxamide

Systemtic Name: (4Z)-N-[2-(2-hydroxyethylamino)ethyl]-4-phenethylidene-2-(trifluoromethyl)oxepane-2-carboxamide Openeye Name: (4Z)-N-[2-(2-hydroxyethylamino)ethyl]-4-phenethylidene-2-(trifluoromethyl)oxepane-2-carboxamide CAS Name: (4Z)-N-[2-(2-hydroxyethylamino)ethyl]-4-phenethylidene-2-(trifluoromethyl)-2-oxepanecarboxamide IUPAC Name: (4Z)-N-[2-(2-hydroxyethylamino)ethyl]-4-phenethylidene-2-(trifluoromethyl)oxepane-2-carboxamide Traditional Name: (4Z)-N-[2-(2-hydroxyethylamino)ethyl]-4-phenethylidene-2-(trifluoromethyl)oxepane-2-carboxamide Formula: C20H27F3N2O3 MolecularWeight: 400.43519

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=CCC2=CC=CC=C2)CC(OC1)(C(=O)NCCNCCO)C(F)(F)F

Isomeric SMILES

C1C/C(=C/CC2=CC=CC=C2)/CC(OC1)(C(=O)NCCNCCO)C(F)(F)F

InChI

InChI=1S/C20H27F3N2O3/c21-20(22,23)19(18(27)25-11-10-24-12-13-26)15-17(7-4-14-28-19)9-8-16-5-2-1-3-6-16/h1-3,5-6,9,24,26H,4,7-8,10-15H2,(H,25,27)/b17-9-