4-(5,5-dimethyl-2-oxidanylidene-1H-4,1-benzoxazepin-7-yl)furan-2-carbonitrile

Systemtic Name: 4-(5,5-dimethyl-2-oxidanylidene-1H-4,1-benzoxazepin-7-yl)furan-2-carbonitrile Openeye Name: 4-(5,5-dimethyl-2-oxo-1H-4,1-benzoxazepin-7-yl)furan-2-carbonitrile CAS Name: 4-(5,5-dimethyl-2-oxo-1H-4,1-benzoxazepin-7-yl)-2-furancarbonitrile IUPAC Name: 4-(5,5-dimethyl-2-oxo-1H-4,1-benzoxazepin-7-yl)furan-2-carbonitrile Traditional Name: 4-(2-keto-5,5-dimethyl-1H-4,1-benzoxazepin-7-yl)-2-furonitrile Formula: C16H14N2O3 MolecularWeight: 282.29396

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=C(C=CC(=C2)C3=COC(=C3)C#N)NC(=O)CO1)C

Isomeric SMILES

CC1(C2=C(C=CC(=C2)C3=COC(=C3)C#N)NC(=O)CO1)C

InChI

InChI=1S/C16H14N2O3/c1-16(2)13-6-10(11-5-12(7-17)20-8-11)3-4-14(13)18-15(19)9-21-16/h3-6,8H,9H2,1-2H3,(H,18,19)