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

Systemtic Name: ethyl 4-methyl-3-[[4-(4-methylphenyl)sulfonyl-2,3-dihydro-1,4-benzoxazin-2-yl]carbonylamino]benzoate Openeye Name: ethyl 4-methyl-3-[[4-(p-tolylsulfonyl)-2,3-dihydro-1,4-benzoxazine-2-carbonyl]amino]benzoate CAS Name: 4-methyl-3-[[[4-(4-methylphenyl)sulfonyl-2,3-dihydro-1,4-benzoxazin-2-yl]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-methyl-3-[[4-(4-methylphenyl)sulfonyl-2,3-dihydro-1,4-benzoxazine-2-carbonyl]amino]benzoate Traditional Name: 4-methyl-3-[(4-tosyl-2,3-dihydro-1,4-benzoxazine-2-carbonyl)amino]benzoic acid ethyl ester Formula: C26H26N2O6S MolecularWeight: 494.55944

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H26N2O6S/c1-4-33-26(30)19-12-11-18(3)21(15-19)27-25(29)24-16-28(22-7-5-6-8-23(22)34-24)35(31,32)20-13-9-17(2)10-14-20/h5-15,24H,4,16H2,1-3H3,(H,27,29)