3-[5-chloranyl-2-oxidanylidene-7-(phenylcarbonyl)-1,3-benzoxazol-3-yl]propanenitrile

Systemtic Name: 3-[5-chloranyl-2-oxidanylidene-7-(phenylcarbonyl)-1,3-benzoxazol-3-yl]propanenitrile Openeye Name: 3-(7-benzoyl-5-chloro-2-oxo-1,3-benzoxazol-3-yl)propanenitrile CAS Name: 3-(7-benzoyl-5-chloro-2-oxo-1,3-benzoxazol-3-yl)propanenitrile IUPAC Name: 3-(7-benzoyl-5-chloro-2-oxo-1,3-benzoxazol-3-yl)propanenitrile Traditional Name: 3-(7-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=CC(=CC3=C2OC(=O)N3CCC#N)Cl

Isomeric SMILES

C1=CC=C(C=C1)C(=O)C2=CC(=CC3=C2OC(=O)N3CCC#N)Cl

InChI

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