N-[2-[5-[(4-methoxy-2,5-dimethyl-phenyl)methyl]-2,3,3a,4,6,6a-hexahydropyrrolo[2,3-c]pyrrol-1-yl]-2-oxidanylidene-ethyl]-3-(trifluoromethyl)benzamide

Systemtic Name: N-[2-[5-[(4-methoxy-2,5-dimethyl-phenyl)methyl]-2,3,3a,4,6,6a-hexahydropyrrolo[2,3-c]pyrrol-1-yl]-2-oxidanylidene-ethyl]-3-(trifluoromethyl)benzamide Openeye Name: N-[2-[5-[(4-methoxy-2,5-dimethyl-phenyl)methyl]-2,3,3a,4,6,6a-hexahydropyrrolo[2,3-c]pyrrol-1-yl]-2-oxo-ethyl]-3-(trifluoromethyl)benzamide CAS Name: N-[2-[5-[(4-methoxy-2,5-dimethylphenyl)methyl]-2,3,3a,4,6,6a-hexahydropyrrolo[2,3-c]pyrrol-1-yl]-2-oxoethyl]-3-(trifluoromethyl)benzamide IUPAC Name: N-[2-[5-[(4-methoxy-2,5-dimethylphenyl)methyl]-2,3,3a,4,6,6a-hexahydropyrrolo[2,3-c]pyrrol-1-yl]-2-oxoethyl]-3-(trifluoromethyl)benzamide Traditional Name: N-[2-keto-2-[5-(4-methoxy-2,5-dimethyl-benzyl)-2,3,3a,4,6,6a-hexahydropyrrolo[2,3-c]pyrrol-1-yl]ethyl]-3-(trifluoromethyl)benzamide Formula: C26H30F3N3O3 MolecularWeight: 489.52991

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1CN2CC3CCN(C3C2)C(=O)CNC(=O)C4=CC(=CC=C4)C(F)(F)F)C)OC

Isomeric SMILES

CC1=CC(=C(C=C1CN2CC3CCN(C3C2)C(=O)CNC(=O)C4=CC(=CC=C4)C(F)(F)F)C)OC

InChI

InChI=1S/C26H30F3N3O3/c1-16-10-23(35-3)17(2)9-20(16)14-31-13-19-7-8-32(22(19)15-31)24(33)12-30-25(34)18-5-4-6-21(11-18)26(27,28)29/h4-6,9-11,19,22H,7-8,12-15H2,1-3H3,(H,30,34)