4-[3-(6-phenyl-1,3-benzoxazol-2-yl)phenoxy]butanenitrile

Systemtic Name: 4-[3-(6-phenyl-1,3-benzoxazol-2-yl)phenoxy]butanenitrile Openeye Name: 4-[3-(6-phenyl-1,3-benzoxazol-2-yl)phenoxy]butanenitrile CAS Name: 4-[3-(6-phenyl-1,3-benzoxazol-2-yl)phenoxy]butanenitrile IUPAC Name: 4-[3-(6-phenyl-1,3-benzoxazol-2-yl)phenoxy]butanenitrile Traditional Name: 4-[3-(6-phenyl-1,3-benzoxazol-2-yl)phenoxy]butyronitrile Formula: C23H18N2O2 MolecularWeight: 354.40122

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC3=C(C=C2)N=C(O3)C4=CC(=CC=C4)OCCCC#N

Isomeric SMILES

C1=CC=C(C=C1)C2=CC3=C(C=C2)N=C(O3)C4=CC(=CC=C4)OCCCC#N

InChI

InChI=1S/C23H18N2O2/c24-13-4-5-14-26-20-10-6-9-19(15-20)23-25-21-12-11-18(16-22(21)27-23)17-7-2-1-3-8-17/h1-3,6-12,15-16H,4-5,14H2