2-[(2R)-6-(2-chloranylethanoyl)-3-oxidanylidene-2-phenyl-1,4-benzoxazin-4-yl]ethanenitrile

Systemtic Name: 2-[(2R)-6-(2-chloranylethanoyl)-3-oxidanylidene-2-phenyl-1,4-benzoxazin-4-yl]ethanenitrile Openeye Name: 2-[(2R)-6-(2-chloroacetyl)-3-oxo-2-phenyl-1,4-benzoxazin-4-yl]acetonitrile CAS Name: 2-[(2R)-6-(2-chloro-1-oxoethyl)-3-oxo-2-phenyl-1,4-benzoxazin-4-yl]acetonitrile IUPAC Name: 2-[(2R)-6-(2-chloroacetyl)-3-oxo-2-phenyl-1,4-benzoxazin-4-yl]acetonitrile Traditional Name: 2-[(2R)-6-(2-chloroacetyl)-3-keto-2-phenyl-1,4-benzoxazin-4-yl]acetonitrile Formula: C18H13ClN2O3 MolecularWeight: 340.76042

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2C(=O)N(C3=C(O2)C=CC(=C3)C(=O)CCl)CC#N

Isomeric SMILES

C1=CC=C(C=C1)[C@@H]2C(=O)N(C3=C(O2)C=CC(=C3)C(=O)CCl)CC#N

InChI

InChI=1S/C18H13ClN2O3/c19-11-15(22)13-6-7-16-14(10-13)21(9-8-20)18(23)17(24-16)12-4-2-1-3-5-12/h1-7,10,17H,9,11H2/t17-/m1/s1