[5-(dimethylamino)-2-[[3-[3-[3-(oxan-2-yloxymethyl)-1,2-oxazol-5-yl]phenyl]-3-oxidanylidene-propanoyl]amino]-4-(trifluoromethyl)phenyl]carbamic acid

Systemtic Name: [5-(dimethylamino)-2-[[3-[3-[3-(oxan-2-yloxymethyl)-1,2-oxazol-5-yl]phenyl]-3-oxidanylidene-propanoyl]amino]-4-(trifluoromethyl)phenyl]carbamic acid Openeye Name: [5-(dimethylamino)-2-[[3-oxo-3-[3-[3-(tetrahydropyran-2-yloxymethyl)isoxazol-5-yl]phenyl]propanoyl]amino]-4-(trifluoromethyl)phenyl]carbamic acid CAS Name: [5-(dimethylamino)-2-[[3-[3-[3-(2-oxanyloxymethyl)-5-isoxazolyl]phenyl]-1,3-dioxopropyl]amino]-4-(trifluoromethyl)phenyl]carbamic acid IUPAC Name: [5-(dimethylamino)-2-[[3-[3-[3-(oxan-2-yloxymethyl)-1,2-oxazol-5-yl]phenyl]-3-oxopropanoyl]amino]-4-(trifluoromethyl)phenyl]carbamic acid Traditional Name: [5-(dimethylamino)-2-[[3-keto-3-[3-[3-(tetrahydropyran-2-yloxymethyl)isoxazol-5-yl]phenyl]propanoyl]amino]-4-(trifluoromethyl)phenyl]carbamic acid Formula: C28H29F3N4O7 MolecularWeight: 590.54767

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC(=C(C=C1C(F)(F)F)NC(=O)CC(=O)C2=CC=CC(=C2)C3=CC(=NO3)COC4CCCCO4)NC(=O)O

Isomeric SMILES

CN(C)C1=CC(=C(C=C1C(F)(F)F)NC(=O)CC(=O)C2=CC=CC(=C2)C3=CC(=NO3)COC4CCCCO4)NC(=O)O

InChI

InChI=1S/C28H29F3N4O7/c1-35(2)22-13-21(33-27(38)39)20(12-19(22)28(29,30)31)32-25(37)14-23(36)16-6-5-7-17(10-16)24-11-18(34-42-24)15-41-26-8-3-4-9-40-26/h5-7,10-13,26,33H,3-4,8-9,14-15H2,1-2H3,(H,32,37)(H,38,39)