4-[imidazol-1-yl-(2-oxidanylidene-3H-1,3-benzoxazol-6-yl)methyl]benzenecarbonitrile

Systemtic Name: 4-[imidazol-1-yl-(2-oxidanylidene-3H-1,3-benzoxazol-6-yl)methyl]benzenecarbonitrile Openeye Name: 4-[imidazol-1-yl-(2-oxo-3H-1,3-benzoxazol-6-yl)methyl]benzonitrile CAS Name: 4-[1-imidazolyl-(2-oxo-3H-1,3-benzoxazol-6-yl)methyl]benzonitrile IUPAC Name: 4-[imidazol-1-yl-(2-oxo-3H-1,3-benzoxazol-6-yl)methyl]benzonitrile Traditional Name: 4-[imidazol-1-yl-(2-keto-3H-1,3-benzoxazol-6-yl)methyl]benzonitrile Formula: C18H12N4O2 MolecularWeight: 316.31348

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#N)C(C2=CC3=C(C=C2)NC(=O)O3)N4C=CN=C4

Isomeric SMILES

C1=CC(=CC=C1C#N)C(C2=CC3=C(C=C2)NC(=O)O3)N4C=CN=C4

InChI

InChI=1S/C18H12N4O2/c19-10-12-1-3-13(4-2-12)17(22-8-7-20-11-22)14-5-6-15-16(9-14)24-18(23)21-15/h1-9,11,17H,(H,21,23)