3-[2-(3-azanyl-4-methoxy-phenyl)-1,3-benzoxazol-5-yl]benzenecarbonitrile

Systemtic Name: 3-[2-(3-azanyl-4-methoxy-phenyl)-1,3-benzoxazol-5-yl]benzenecarbonitrile Openeye Name: 3-[2-(3-amino-4-methoxy-phenyl)-1,3-benzoxazol-5-yl]benzonitrile CAS Name: 3-[2-(3-amino-4-methoxyphenyl)-1,3-benzoxazol-5-yl]benzonitrile IUPAC Name: 3-[2-(3-amino-4-methoxyphenyl)-1,3-benzoxazol-5-yl]benzonitrile Traditional Name: 3-[2-(3-amino-4-methoxy-phenyl)-1,3-benzoxazol-5-yl]benzonitrile Formula: C21H15N3O2 MolecularWeight: 341.3627

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NC3=C(O2)C=CC(=C3)C4=CC=CC(=C4)C#N)N

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NC3=C(O2)C=CC(=C3)C4=CC=CC(=C4)C#N)N

InChI

InChI=1S/C21H15N3O2/c1-25-19-7-6-16(10-17(19)23)21-24-18-11-15(5-8-20(18)26-21)14-4-2-3-13(9-14)12-22/h2-11H,23H2,1H3