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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C=CC(=C2)C(=O)C(C)Cl)OC(C1=O)(C)C

Isomeric SMILES

CCCCN1C2=C(C=CC(=C2)C(=O)[C@H](C)Cl)OC(C1=O)(C)C

InChI

InChI=1S/C17H22ClNO3/c1-5-6-9-19-13-10-12(15(20)11(2)18)7-8-14(13)22-17(3,4)16(19)21/h7-8,10-11H,5-6,9H2,1-4H3/t11-/m0/s1