2-[2-[3,5-bis(fluoranyl)phenyl]ethanoylamino]-N-[6-oxidanylidene-7-[2,2,2-tris(fluoranyl)ethyl]-7H-benzo[d][1]benzazepin-5-yl]propanamide

Systemtic Name: 2-[2-[3,5-bis(fluoranyl)phenyl]ethanoylamino]-N-[6-oxidanylidene-7-[2,2,2-tris(fluoranyl)ethyl]-7H-benzo[d][1]benzazepin-5-yl]propanamide Openeye Name: 2-[[2-(3,5-difluorophenyl)acetyl]amino]-N-[6-oxo-7-(2,2,2-trifluoroethyl)-7H-benzo[d][1]benzazepin-5-yl]propanamide CAS Name: 2-[[2-(3,5-difluorophenyl)-1-oxoethyl]amino]-N-[6-oxo-7-(2,2,2-trifluoroethyl)-7H-benzo[d][1]benzazepin-5-yl]propanamide IUPAC Name: 2-[[2-(3,5-difluorophenyl)acetyl]amino]-N-[6-oxo-7-(2,2,2-trifluoroethyl)-7H-benzo[d][1]benzazepin-5-yl]propanamide Traditional Name: 2-[[2-(3,5-difluorophenyl)acetyl]amino]-N-[6-keto-7-(2,2,2-trifluoroethyl)-7H-benzo[d][1]benzazepin-5-yl]propionamide Formula: C27H22F5N3O3 MolecularWeight: 531.473896

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NN1C2=CC=CC=C2C3=CC=CC=C3C(C1=O)CC(F)(F)F)NC(=O)CC4=CC(=CC(=C4)F)F

Isomeric SMILES

CC(C(=O)NN1C2=CC=CC=C2C3=CC=CC=C3C(C1=O)CC(F)(F)F)NC(=O)CC4=CC(=CC(=C4)F)F

InChI

InChI=1S/C27H22F5N3O3/c1-15(33-24(36)12-16-10-17(28)13-18(29)11-16)25(37)34-35-23-9-5-4-8-21(23)19-6-2-3-7-20(19)22(26(35)38)14-27(30,31)32/h2-11,13,15,22H,12,14H2,1H3,(H,33,36)(H,34,37)