5-(4,4-dimethyl-2-oxidanylidene-1H-3,1-benzoxazin-6-yl)pyridine-3-carbonitrile

Systemtic Name: 5-(4,4-dimethyl-2-oxidanylidene-1H-3,1-benzoxazin-6-yl)pyridine-3-carbonitrile Openeye Name: 5-(4,4-dimethyl-2-oxo-1H-3,1-benzoxazin-6-yl)pyridine-3-carbonitrile CAS Name: 5-(4,4-dimethyl-2-oxo-1H-3,1-benzoxazin-6-yl)-3-pyridinecarbonitrile IUPAC Name: 5-(4,4-dimethyl-2-oxo-1H-3,1-benzoxazin-6-yl)pyridine-3-carbonitrile Traditional Name: 5-(2-keto-4,4-dimethyl-1H-3,1-benzoxazin-6-yl)nicotinonitrile Formula: C16H13N3O2 MolecularWeight: 279.29332

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=C(C=CC(=C2)C3=CN=CC(=C3)C#N)NC(=O)O1)C

Isomeric SMILES

CC1(C2=C(C=CC(=C2)C3=CN=CC(=C3)C#N)NC(=O)O1)C

InChI

InChI=1S/C16H13N3O2/c1-16(2)13-6-11(3-4-14(13)19-15(20)21-16)12-5-10(7-17)8-18-9-12/h3-6,8-9H,1-2H3,(H,19,20)