N-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-2-oxidanylidene-ethyl]-4-(trifluoromethyl)benzamide

Systemtic Name: N-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-2-oxidanylidene-ethyl]-4-(trifluoromethyl)benzamide Openeye Name: N-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-2-oxo-ethyl]-4-(trifluoromethyl)benzamide CAS Name: N-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-2-oxoethyl]-4-(trifluoromethyl)benzamide IUPAC Name: N-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-2-oxoethyl]-4-(trifluoromethyl)benzamide Traditional Name: N-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-2-keto-ethyl]-4-(trifluoromethyl)benzamide Formula: C19H17F3N2O4 MolecularWeight: 394.34449

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)NC(=O)CNC(=O)C3=CC=C(C=C3)C(F)(F)F)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)NC(=O)CNC(=O)C3=CC=C(C=C3)C(F)(F)F)OC1

InChI

InChI=1S/C19H17F3N2O4/c20-19(21,22)13-4-2-12(3-5-13)18(26)23-11-17(25)24-14-6-7-15-16(10-14)28-9-1-8-27-15/h2-7,10H,1,8-9,11H2,(H,23,26)(H,24,25)