(4-methylsulfanylphenyl)methyl 2-(3-oxidanylidene-4H-1,4-benzoxazin-2-yl)ethanoate

Systemtic Name: (4-methylsulfanylphenyl)methyl 2-(3-oxidanylidene-4H-1,4-benzoxazin-2-yl)ethanoate Openeye Name: (4-methylsulfanylphenyl)methyl 2-(3-oxo-4H-1,4-benzoxazin-2-yl)acetate CAS Name: 2-(3-oxo-4H-1,4-benzoxazin-2-yl)acetic acid [4-(methylthio)phenyl]methyl ester IUPAC Name: (4-methylsulfanylphenyl)methyl 2-(3-oxo-4H-1,4-benzoxazin-2-yl)acetate Traditional Name: 2-(3-keto-4H-1,4-benzoxazin-2-yl)acetic acid [4-(methylthio)benzyl] ester Formula: C18H17NO4S MolecularWeight: 343.39688

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)COC(=O)CC2C(=O)NC3=CC=CC=C3O2

Isomeric SMILES

CSC1=CC=C(C=C1)COC(=O)CC2C(=O)NC3=CC=CC=C3O2

InChI

InChI=1S/C18H17NO4S/c1-24-13-8-6-12(7-9-13)11-22-17(20)10-16-18(21)19-14-4-2-3-5-15(14)23-16/h2-9,16H,10-11H2,1H3,(H,19,21)