4-chloranyl-2-[3-(2-hydroxyethylamino)-1-(1,2-oxazol-5-yl)propoxy]benzenecarbonitrile

Systemtic Name: 4-chloranyl-2-[3-(2-hydroxyethylamino)-1-(1,2-oxazol-5-yl)propoxy]benzenecarbonitrile Openeye Name: 4-chloro-2-[3-(2-hydroxyethylamino)-1-isoxazol-5-yl-propoxy]benzonitrile CAS Name: 4-chloro-2-[3-(2-hydroxyethylamino)-1-(5-isoxazolyl)propoxy]benzonitrile IUPAC Name: 4-chloro-2-[3-(2-hydroxyethylamino)-1-(1,2-oxazol-5-yl)propoxy]benzonitrile Traditional Name: 4-chloro-2-[3-(2-hydroxyethylamino)-1-isoxazol-5-yl-propoxy]benzonitrile Formula: C15H16ClN3O3 MolecularWeight: 321.75884

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Cl)OC(CCNCCO)C2=CC=NO2)C#N

Isomeric SMILES

C1=CC(=C(C=C1Cl)OC(CCNCCO)C2=CC=NO2)C#N

InChI

InChI=1S/C15H16ClN3O3/c16-12-2-1-11(10-17)15(9-12)21-13(3-5-18-7-8-20)14-4-6-19-22-14/h1-2,4,6,9,13,18,20H,3,5,7-8H2