3-[5-chloranyl-2-oxidanylidene-6-(phenylcarbonyl)-1,3-benzoxazol-3-yl]propanenitrile

Systemtic Name: 3-[5-chloranyl-2-oxidanylidene-6-(phenylcarbonyl)-1,3-benzoxazol-3-yl]propanenitrile Openeye Name: 3-(6-benzoyl-5-chloro-2-oxo-1,3-benzoxazol-3-yl)propanenitrile CAS Name: 3-(6-benzoyl-5-chloro-2-oxo-1,3-benzoxazol-3-yl)propanenitrile IUPAC Name: 3-(6-benzoyl-5-chloro-2-oxo-1,3-benzoxazol-3-yl)propanenitrile Traditional Name: 3-(6-benzoyl-5-chloro-2-keto-1,3-benzoxazol-3-yl)propionitrile Formula: C17H11ClN2O3 MolecularWeight: 326.73384

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C2=CC3=C(C=C2Cl)N(C(=O)O3)CCC#N

Isomeric SMILES

C1=CC=C(C=C1)C(=O)C2=CC3=C(C=C2Cl)N(C(=O)O3)CCC#N

InChI

InChI=1S/C17H11ClN2O3/c18-13-10-14-15(23-17(22)20(14)8-4-7-19)9-12(13)16(21)11-5-2-1-3-6-11/h1-3,5-6,9-10H,4,8H2