4-[[5,5-bis(fluoranyl)-3,4-dihydro-2H-1-benzazepin-1-yl]carbonyl]-2-methyl-benzenecarbonitrile

Systemtic Name: 4-[[5,5-bis(fluoranyl)-3,4-dihydro-2H-1-benzazepin-1-yl]carbonyl]-2-methyl-benzenecarbonitrile Openeye Name: 4-(5,5-difluoro-3,4-dihydro-2H-1-benzazepine-1-carbonyl)-2-methyl-benzonitrile CAS Name: 4-[(5,5-difluoro-3,4-dihydro-2H-1-benzazepin-1-yl)-oxomethyl]-2-methylbenzonitrile IUPAC Name: 4-(5,5-difluoro-3,4-dihydro-2H-1-benzazepine-1-carbonyl)-2-methylbenzonitrile Traditional Name: 4-(5,5-difluoro-3,4-dihydro-2H-1-benzazepine-1-carbonyl)-2-methyl-benzonitrile Formula: C19H16F2N2O MolecularWeight: 326.339946

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)N2CCCC(C3=CC=CC=C32)(F)F)C#N

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)N2CCCC(C3=CC=CC=C32)(F)F)C#N

InChI

InChI=1S/C19H16F2N2O/c1-13-11-14(7-8-15(13)12-22)18(24)23-10-4-9-19(20,21)16-5-2-3-6-17(16)23/h2-3,5-8,11H,4,9-10H2,1H3