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

Systemtic Name: 3-(3-oxidanylidene-2-phenyl-1,4-benzoxazin-4-yl)propanenitrile Openeye Name: 3-(3-oxo-2-phenyl-1,4-benzoxazin-4-yl)propanenitrile CAS Name: 3-(3-oxo-2-phenyl-1,4-benzoxazin-4-yl)propanenitrile IUPAC Name: 3-(3-oxo-2-phenyl-1,4-benzoxazin-4-yl)propanenitrile Traditional Name: 3-(3-keto-2-phenyl-1,4-benzoxazin-4-yl)propionitrile Formula: C17H14N2O2 MolecularWeight: 278.30526

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H14N2O2/c18-11-6-12-19-14-9-4-5-10-15(14)21-16(17(19)20)13-7-2-1-3-8-13/h1-5,7-10,16H,6,12H2