2-[6-(3-chlorophenyl)carbonyl-2-oxidanylidene-1,3-benzoxazol-3-yl]ethanenitrile

Systemtic Name: 2-[6-(3-chlorophenyl)carbonyl-2-oxidanylidene-1,3-benzoxazol-3-yl]ethanenitrile Openeye Name: 2-[6-(3-chlorobenzoyl)-2-oxo-1,3-benzoxazol-3-yl]acetonitrile CAS Name: 2-[6-[(3-chlorophenyl)-oxomethyl]-2-oxo-1,3-benzoxazol-3-yl]acetonitrile IUPAC Name: 2-[6-(3-chlorobenzoyl)-2-oxo-1,3-benzoxazol-3-yl]acetonitrile Traditional Name: 2-[6-(3-chlorobenzoyl)-2-keto-1,3-benzoxazol-3-yl]acetonitrile Formula: C16H9ClN2O3 MolecularWeight: 312.70726

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H9ClN2O3/c17-12-3-1-2-10(8-12)15(20)11-4-5-13-14(9-11)22-16(21)19(13)7-6-18/h1-5,8-9H,7H2