6-[4-(3,4-dichlorophenyl)sulfanylbutoxy]-4,4,8-trimethyl-1H-3,1-benzoxazin-2-one

Systemtic Name: 6-[4-(3,4-dichlorophenyl)sulfanylbutoxy]-4,4,8-trimethyl-1H-3,1-benzoxazin-2-one Openeye Name: 6-[4-(3,4-dichlorophenyl)sulfanylbutoxy]-4,4,8-trimethyl-1H-3,1-benzoxazin-2-one CAS Name: 6-[4-[(3,4-dichlorophenyl)thio]butoxy]-4,4,8-trimethyl-1H-3,1-benzoxazin-2-one IUPAC Name: 6-[4-(3,4-dichlorophenyl)sulfanylbutoxy]-4,4,8-trimethyl-1H-3,1-benzoxazin-2-one Traditional Name: 6-[4-[(3,4-dichlorophenyl)thio]butoxy]-4,4,8-trimethyl-1H-3,1-benzoxazin-2-one Formula: C21H23Cl2NO3S MolecularWeight: 440.38322

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=C1)OCCCCSC3=CC(=C(C=C3)Cl)Cl)C(OC(=O)N2)(C)C

Isomeric SMILES

CC1=C2C(=CC(=C1)OCCCCSC3=CC(=C(C=C3)Cl)Cl)C(OC(=O)N2)(C)C

InChI

InChI=1S/C21H23Cl2NO3S/c1-13-10-14(11-16-19(13)24-20(25)27-21(16,2)3)26-8-4-5-9-28-15-6-7-17(22)18(23)12-15/h6-7,10-12H,4-5,8-9H2,1-3H3,(H,24,25)