ethyl 4-(4-bromanyl-2-methanoyl-phenyl)-4-[(4-methylphenyl)sulfonylamino]butanoate

Systemtic Name: ethyl 4-(4-bromanyl-2-methanoyl-phenyl)-4-[(4-methylphenyl)sulfonylamino]butanoate Openeye Name: ethyl 4-(4-bromo-2-formyl-phenyl)-4-(p-tolylsulfonylamino)butanoate CAS Name: 4-(4-bromo-2-formylphenyl)-4-[(4-methylphenyl)sulfonylamino]butanoic acid ethyl ester IUPAC Name: ethyl 4-(4-bromo-2-formylphenyl)-4-[(4-methylphenyl)sulfonylamino]butanoate Traditional Name: 4-(4-bromo-2-formyl-phenyl)-4-(tosylamino)butyric acid ethyl ester Formula: C20H22BrNO5S MolecularWeight: 468.36138

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC(C1=C(C=C(C=C1)Br)C=O)NS(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCOC(=O)CCC(C1=C(C=C(C=C1)Br)C=O)NS(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C20H22BrNO5S/c1-3-27-20(24)11-10-19(18-9-6-16(21)12-15(18)13-23)22-28(25,26)17-7-4-14(2)5-8-17/h4-9,12-13,19,22H,3,10-11H2,1-2H3