2-[3-azanyl-1-(1,2-oxazol-3-yl)propoxy]-4-chloranyl-benzenecarbonitrile

Systemtic Name: 2-[3-azanyl-1-(1,2-oxazol-3-yl)propoxy]-4-chloranyl-benzenecarbonitrile Openeye Name: 2-(3-amino-1-isoxazol-3-yl-propoxy)-4-chloro-benzonitrile CAS Name: 2-[3-amino-1-(3-isoxazolyl)propoxy]-4-chlorobenzonitrile IUPAC Name: 2-[3-amino-1-(1,2-oxazol-3-yl)propoxy]-4-chlorobenzonitrile Traditional Name: 2-(3-amino-1-isoxazol-3-yl-propoxy)-4-chloro-benzonitrile Formula: C13H12ClN3O2 MolecularWeight: 277.70628

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Cl)OC(CCN)C2=NOC=C2)C#N

Isomeric SMILES

C1=CC(=C(C=C1Cl)OC(CCN)C2=NOC=C2)C#N

InChI

InChI=1S/C13H12ClN3O2/c14-10-2-1-9(8-16)13(7-10)19-12(3-5-15)11-4-6-18-17-11/h1-2,4,6-7,12H,3,5,15H2