ethyl 3-[(4-bromanyl-2-ethyl-phenyl)sulfonylamino]butanoate

Systemtic Name: ethyl 3-[(4-bromanyl-2-ethyl-phenyl)sulfonylamino]butanoate Openeye Name: ethyl 3-[(4-bromo-2-ethyl-phenyl)sulfonylamino]butanoate CAS Name: 3-[(4-bromo-2-ethylphenyl)sulfonylamino]butanoic acid ethyl ester IUPAC Name: ethyl 3-[(4-bromo-2-ethylphenyl)sulfonylamino]butanoate Traditional Name: 3-[(4-bromo-2-ethyl-phenyl)sulfonylamino]butyric acid ethyl ester Formula: C14H20BrNO4S MolecularWeight: 378.2819

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=C1)Br)S(=O)(=O)NC(C)CC(=O)OCC

Isomeric SMILES

CCC1=C(C=CC(=C1)Br)S(=O)(=O)NC(C)CC(=O)OCC

InChI

InChI=1S/C14H20BrNO4S/c1-4-11-9-12(15)6-7-13(11)21(18,19)16-10(3)8-14(17)20-5-2/h6-7,9-10,16H,4-5,8H2,1-3H3