6-(2-chloranylethanoyl)-2,2-dimethyl-4-[(1S)-1-phenylethyl]-1,4-benzoxazin-3-one

Systemtic Name: 6-(2-chloranylethanoyl)-2,2-dimethyl-4-[(1S)-1-phenylethyl]-1,4-benzoxazin-3-one Openeye Name: 6-(2-chloroacetyl)-2,2-dimethyl-4-[(1S)-1-phenylethyl]-1,4-benzoxazin-3-one CAS Name: 6-(2-chloro-1-oxoethyl)-2,2-dimethyl-4-[(1S)-1-phenylethyl]-1,4-benzoxazin-3-one IUPAC Name: 6-(2-chloroacetyl)-2,2-dimethyl-4-[(1S)-1-phenylethyl]-1,4-benzoxazin-3-one Traditional Name: 6-(2-chloroacetyl)-2,2-dimethyl-4-[(1S)-1-phenylethyl]-1,4-benzoxazin-3-one Formula: C20H20ClNO3 MolecularWeight: 357.8307

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)N2C3=C(C=CC(=C3)C(=O)CCl)OC(C2=O)(C)C

Isomeric SMILES

C[C@@H](C1=CC=CC=C1)N2C3=C(C=CC(=C3)C(=O)CCl)OC(C2=O)(C)C

InChI

InChI=1S/C20H20ClNO3/c1-13(14-7-5-4-6-8-14)22-16-11-15(17(23)12-21)9-10-18(16)25-20(2,3)19(22)24/h4-11,13H,12H2,1-3H3/t13-/m0/s1