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

Systemtic Name: butyl 4-[[4-(4-chlorophenyl)sulfonyl-2,3-dihydro-1,4-benzoxazin-2-yl]carbonylamino]benzoate Openeye Name: butyl 4-[[4-(4-chlorophenyl)sulfonyl-2,3-dihydro-1,4-benzoxazine-2-carbonyl]amino]benzoate CAS Name: 4-[[[4-(4-chlorophenyl)sulfonyl-2,3-dihydro-1,4-benzoxazin-2-yl]-oxomethyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[[4-(4-chlorophenyl)sulfonyl-2,3-dihydro-1,4-benzoxazine-2-carbonyl]amino]benzoate Traditional Name: 4-[[4-(4-chlorophenyl)sulfonyl-2,3-dihydro-1,4-benzoxazine-2-carbonyl]amino]benzoic acid butyl ester Formula: C26H25ClN2O6S MolecularWeight: 529.0045

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H25ClN2O6S/c1-2-3-16-34-26(31)18-8-12-20(13-9-18)28-25(30)24-17-29(22-6-4-5-7-23(22)35-24)36(32,33)21-14-10-19(27)11-15-21/h4-15,24H,2-3,16-17H2,1H3,(H,28,30)