5-(methylamino)-2-(phenylmethyl)-4-[2-propan-2-yloxy-3-(trifluoromethyl)phenyl]furan-3-one

Systemtic Name: 5-(methylamino)-2-(phenylmethyl)-4-[2-propan-2-yloxy-3-(trifluoromethyl)phenyl]furan-3-one Openeye Name: 2-benzyl-4-[2-isopropoxy-3-(trifluoromethyl)phenyl]-5-(methylamino)furan-3-one CAS Name: 5-(methylamino)-2-(phenylmethyl)-4-[2-propan-2-yloxy-3-(trifluoromethyl)phenyl]-3-furanone IUPAC Name: 2-benzyl-5-(methylamino)-4-[2-propan-2-yloxy-3-(trifluoromethyl)phenyl]furan-3-one Traditional Name: 2-benzyl-4-[2-isopropoxy-3-(trifluoromethyl)phenyl]-5-(methylamino)furan-3-one Formula: C22H22F3NO3 MolecularWeight: 405.41019

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=CC=C1C(F)(F)F)C2=C(OC(C2=O)CC3=CC=CC=C3)NC

Isomeric SMILES

CC(C)OC1=C(C=CC=C1C(F)(F)F)C2=C(OC(C2=O)CC3=CC=CC=C3)NC

InChI

InChI=1S/C22H22F3NO3/c1-13(2)28-20-15(10-7-11-16(20)22(23,24)25)18-19(27)17(29-21(18)26-3)12-14-8-5-4-6-9-14/h4-11,13,17,26H,12H2,1-3H3