8-chloranyl-4,4-dimethyl-6-[4-(phenylsulfinyl)butoxy]-1H-3,1-benzoxazin-2-one

Systemtic Name: 8-chloranyl-4,4-dimethyl-6-[4-(phenylsulfinyl)butoxy]-1H-3,1-benzoxazin-2-one Openeye Name: 6-[4-(benzenesulfinyl)butoxy]-8-chloro-4,4-dimethyl-1H-3,1-benzoxazin-2-one CAS Name: 6-[4-(benzenesulfinyl)butoxy]-8-chloro-4,4-dimethyl-1H-3,1-benzoxazin-2-one IUPAC Name: 6-[4-(benzenesulfinyl)butoxy]-8-chloro-4,4-dimethyl-1H-3,1-benzoxazin-2-one Traditional Name: 6-[4-(benzenesulfinyl)butoxy]-8-chloro-4,4-dimethyl-1H-3,1-benzoxazin-2-one Formula: C20H22ClNO4S MolecularWeight: 407.91098

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=CC(=CC(=C2NC(=O)O1)Cl)OCCCCS(=O)C3=CC=CC=C3)C

Isomeric SMILES

CC1(C2=CC(=CC(=C2NC(=O)O1)Cl)OCCCCS(=O)C3=CC=CC=C3)C

InChI

InChI=1S/C20H22ClNO4S/c1-20(2)16-12-14(13-17(21)18(16)22-19(23)26-20)25-10-6-7-11-27(24)15-8-4-3-5-9-15/h3-5,8-9,12-13H,6-7,10-11H2,1-2H3,(H,22,23)