4-[(7-azanyl-3-oxidanylidene-1,4-benzoxazin-4-yl)methyl]benzenecarbonitrile

Systemtic Name: 4-[(7-azanyl-3-oxidanylidene-1,4-benzoxazin-4-yl)methyl]benzenecarbonitrile Openeye Name: 4-[(7-amino-3-oxo-1,4-benzoxazin-4-yl)methyl]benzonitrile CAS Name: 4-[(7-amino-3-oxo-1,4-benzoxazin-4-yl)methyl]benzonitrile IUPAC Name: 4-[(7-amino-3-oxo-1,4-benzoxazin-4-yl)methyl]benzonitrile Traditional Name: 4-[(7-amino-3-keto-1,4-benzoxazin-4-yl)methyl]benzonitrile Formula: C16H13N3O2 MolecularWeight: 279.29332

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)N(C2=C(O1)C=C(C=C2)N)CC3=CC=C(C=C3)C#N

Isomeric SMILES

C1C(=O)N(C2=C(O1)C=C(C=C2)N)CC3=CC=C(C=C3)C#N

InChI

InChI=1S/C16H13N3O2/c17-8-11-1-3-12(4-2-11)9-19-14-6-5-13(18)7-15(14)21-10-16(19)20/h1-7H,9-10,18H2