3-(4,4-dimethyl-2-oxidanylidene-1H-3,1-benzoxazin-6-yl)-5-methyl-benzenecarbonitrile

Systemtic Name: 3-(4,4-dimethyl-2-oxidanylidene-1H-3,1-benzoxazin-6-yl)-5-methyl-benzenecarbonitrile Openeye Name: 3-(4,4-dimethyl-2-oxo-1H-3,1-benzoxazin-6-yl)-5-methyl-benzonitrile CAS Name: 3-(4,4-dimethyl-2-oxo-1H-3,1-benzoxazin-6-yl)-5-methylbenzonitrile IUPAC Name: 3-(4,4-dimethyl-2-oxo-1H-3,1-benzoxazin-6-yl)-5-methylbenzonitrile Traditional Name: 3-(2-keto-4,4-dimethyl-1H-3,1-benzoxazin-6-yl)-5-methyl-benzonitrile Formula: C18H16N2O2 MolecularWeight: 292.33184

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C2=CC3=C(C=C2)NC(=O)OC3(C)C)C#N

Isomeric SMILES

CC1=CC(=CC(=C1)C2=CC3=C(C=C2)NC(=O)OC3(C)C)C#N

InChI

InChI=1S/C18H16N2O2/c1-11-6-12(10-19)8-14(7-11)13-4-5-16-15(9-13)18(2,3)22-17(21)20-16/h4-9H,1-3H3,(H,20,21)