ethyl 3-[[4-(4-methylphenyl)sulfonyl-2,3-dihydro-1,4-benzoxazin-2-yl]carbonylamino]benzoate

Systemtic Name: ethyl 3-[[4-(4-methylphenyl)sulfonyl-2,3-dihydro-1,4-benzoxazin-2-yl]carbonylamino]benzoate Openeye Name: ethyl 3-[[4-(p-tolylsulfonyl)-2,3-dihydro-1,4-benzoxazine-2-carbonyl]amino]benzoate CAS Name: 3-[[[4-(4-methylphenyl)sulfonyl-2,3-dihydro-1,4-benzoxazin-2-yl]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-[[4-(4-methylphenyl)sulfonyl-2,3-dihydro-1,4-benzoxazine-2-carbonyl]amino]benzoate Traditional Name: 3-[(4-tosyl-2,3-dihydro-1,4-benzoxazine-2-carbonyl)amino]benzoic acid ethyl ester Formula: C25H24N2O6S MolecularWeight: 480.53286

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC=C1)NC(=O)C2CN(C3=CC=CC=C3O2)S(=O)(=O)C4=CC=C(C=C4)C

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)NC(=O)C2CN(C3=CC=CC=C3O2)S(=O)(=O)C4=CC=C(C=C4)C

InChI

InChI=1S/C25H24N2O6S/c1-3-32-25(29)18-7-6-8-19(15-18)26-24(28)23-16-27(21-9-4-5-10-22(21)33-23)34(30,31)20-13-11-17(2)12-14-20/h4-15,23H,3,16H2,1-2H3,(H,26,28)