N-methyl-N-[1-(4-methylsulfonylphenyl)ethyl]-3-oxidanylidene-4H-1,4-benzoxazine-7-carboxamide

Systemtic Name: N-methyl-N-[1-(4-methylsulfonylphenyl)ethyl]-3-oxidanylidene-4H-1,4-benzoxazine-7-carboxamide Openeye Name: N-methyl-N-[1-(4-methylsulfonylphenyl)ethyl]-3-oxo-4H-1,4-benzoxazine-7-carboxamide CAS Name: N-methyl-N-[1-(4-methylsulfonylphenyl)ethyl]-3-oxo-4H-1,4-benzoxazine-7-carboxamide IUPAC Name: N-methyl-N-[1-(4-methylsulfonylphenyl)ethyl]-3-oxo-4H-1,4-benzoxazine-7-carboxamide Traditional Name: 3-keto-N-[1-(4-mesylphenyl)ethyl]-N-methyl-4H-1,4-benzoxazine-7-carboxamide Formula: C19H20N2O5S MolecularWeight: 388.4375

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)S(=O)(=O)C)N(C)C(=O)C2=CC3=C(C=C2)NC(=O)CO3

Isomeric SMILES

CC(C1=CC=C(C=C1)S(=O)(=O)C)N(C)C(=O)C2=CC3=C(C=C2)NC(=O)CO3

InChI

InChI=1S/C19H20N2O5S/c1-12(13-4-7-15(8-5-13)27(3,24)25)21(2)19(23)14-6-9-16-17(10-14)26-11-18(22)20-16/h4-10,12H,11H2,1-3H3,(H,20,22)