6-[(2S)-2-chloranylpropanoyl]-2,2-dimethyl-4-(2-methylpropyl)-1,4-benzoxazin-3-one

Systemtic Name: 6-[(2S)-2-chloranylpropanoyl]-2,2-dimethyl-4-(2-methylpropyl)-1,4-benzoxazin-3-one Openeye Name: 6-[(2S)-2-chloropropanoyl]-4-isobutyl-2,2-dimethyl-1,4-benzoxazin-3-one CAS Name: 6-[(2S)-2-chloro-1-oxopropyl]-2,2-dimethyl-4-(2-methylpropyl)-1,4-benzoxazin-3-one IUPAC Name: 6-[(2S)-2-chloropropanoyl]-2,2-dimethyl-4-(2-methylpropyl)-1,4-benzoxazin-3-one Traditional Name: 6-[(2S)-2-chloropropanoyl]-4-isobutyl-2,2-dimethyl-1,4-benzoxazin-3-one Formula: C17H22ClNO3 MolecularWeight: 323.81448

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C2=C(C=CC(=C2)C(=O)C(C)Cl)OC(C1=O)(C)C

Isomeric SMILES

C[C@@H](C(=O)C1=CC2=C(C=C1)OC(C(=O)N2CC(C)C)(C)C)Cl

InChI

InChI=1S/C17H22ClNO3/c1-10(2)9-19-13-8-12(15(20)11(3)18)6-7-14(13)22-17(4,5)16(19)21/h6-8,10-11H,9H2,1-5H3/t11-/m0/s1