4-(3-oxidanylidene-2-phenyl-1,4-benzoxazin-4-yl)butanenitrile

Systemtic Name: 4-(3-oxidanylidene-2-phenyl-1,4-benzoxazin-4-yl)butanenitrile Openeye Name: 4-(3-oxo-2-phenyl-1,4-benzoxazin-4-yl)butanenitrile CAS Name: 4-(3-oxo-2-phenyl-1,4-benzoxazin-4-yl)butanenitrile IUPAC Name: 4-(3-oxo-2-phenyl-1,4-benzoxazin-4-yl)butanenitrile Traditional Name: 4-(3-keto-2-phenyl-1,4-benzoxazin-4-yl)butyronitrile Formula: C18H16N2O2 MolecularWeight: 292.33184

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2C(=O)N(C3=CC=CC=C3O2)CCCC#N

Isomeric SMILES

C1=CC=C(C=C1)C2C(=O)N(C3=CC=CC=C3O2)CCCC#N

InChI

InChI=1S/C18H16N2O2/c19-12-6-7-13-20-15-10-4-5-11-16(15)22-17(18(20)21)14-8-2-1-3-9-14/h1-5,8-11,17H,6-7,13H2