3-(4-cyanophenyl)-2-(1,2-oxazol-5-ylmethyl)benzenecarbonitrile

Systemtic Name: 3-(4-cyanophenyl)-2-(1,2-oxazol-5-ylmethyl)benzenecarbonitrile Openeye Name: 3-(4-cyanophenyl)-2-(isoxazol-5-ylmethyl)benzonitrile CAS Name: 3-(4-cyanophenyl)-2-(5-isoxazolylmethyl)benzonitrile IUPAC Name: 3-(4-cyanophenyl)-2-(1,2-oxazol-5-ylmethyl)benzonitrile Traditional Name: 3-(4-cyanophenyl)-2-(isoxazol-5-ylmethyl)benzonitrile Formula: C18H11N3O MolecularWeight: 285.29944

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)C2=CC=C(C=C2)C#N)CC3=CC=NO3)C#N

Isomeric SMILES

C1=CC(=C(C(=C1)C2=CC=C(C=C2)C#N)CC3=CC=NO3)C#N

InChI

InChI=1S/C18H11N3O/c19-11-13-4-6-14(7-5-13)17-3-1-2-15(12-20)18(17)10-16-8-9-21-22-16/h1-9H,10H2