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

Systemtic Name: methyl 3-[[4-(4-methylphenyl)sulfonyl-2,3-dihydro-1,4-benzoxazin-2-yl]carbonylamino]benzoate Openeye Name: methyl 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 methyl ester IUPAC Name: methyl 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 methyl ester Formula: C24H22N2O6S MolecularWeight: 466.50628

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CC(OC3=CC=CC=C32)C(=O)NC4=CC=CC(=C4)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CC(OC3=CC=CC=C32)C(=O)NC4=CC=CC(=C4)C(=O)OC

InChI

InChI=1S/C24H22N2O6S/c1-16-10-12-19(13-11-16)33(29,30)26-15-22(32-21-9-4-3-8-20(21)26)23(27)25-18-7-5-6-17(14-18)24(28)31-2/h3-14,22H,15H2,1-2H3,(H,25,27)