methyl (4R)-4-[(1S)-2-methoxy-1-(4-methylphenyl)sulfonyloxy-2-oxidanylidene-ethyl]-6-methyl-4H-1,2-benzoxazine-3-carboxylate

Systemtic Name: methyl (4R)-4-[(1S)-2-methoxy-1-(4-methylphenyl)sulfonyloxy-2-oxidanylidene-ethyl]-6-methyl-4H-1,2-benzoxazine-3-carboxylate Openeye Name: methyl (4R)-4-[(1S)-2-methoxy-2-oxo-1-(p-tolylsulfonyloxy)ethyl]-6-methyl-4H-1,2-benzoxazine-3-carboxylate CAS Name: (4R)-4-[(1S)-2-methoxy-1-(4-methylphenyl)sulfonyloxy-2-oxoethyl]-6-methyl-4H-1,2-benzoxazine-3-carboxylic acid methyl ester IUPAC Name: methyl (4R)-4-[(1S)-2-methoxy-1-(4-methylphenyl)sulfonyloxy-2-oxoethyl]-6-methyl-4H-1,2-benzoxazine-3-carboxylate Traditional Name: (4R)-4-[(1S)-2-keto-2-methoxy-1-tosyloxy-ethyl]-6-methyl-4H-1,2-benzoxazine-3-carboxylic acid methyl ester Formula: C21H21NO8S MolecularWeight: 447.45834

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC(C2C3=C(C=CC(=C3)C)ON=C2C(=O)OC)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)O[C@@H]([C@@H]2C3=C(C=CC(=C3)C)ON=C2C(=O)OC)C(=O)OC

InChI

InChI=1S/C21H21NO8S/c1-12-5-8-14(9-6-12)31(25,26)30-19(21(24)28-4)17-15-11-13(2)7-10-16(15)29-22-18(17)20(23)27-3/h5-11,17,19H,1-4H3/t17-,19+/m1/s1