(phenylmethyl) 2-[(4-bromanyl-2-ethyl-phenyl)sulfonylamino]ethanoate

Systemtic Name: (phenylmethyl) 2-[(4-bromanyl-2-ethyl-phenyl)sulfonylamino]ethanoate Openeye Name: benzyl 2-[(4-bromo-2-ethyl-phenyl)sulfonylamino]acetate CAS Name: 2-[(4-bromo-2-ethylphenyl)sulfonylamino]acetic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[(4-bromo-2-ethylphenyl)sulfonylamino]acetate Traditional Name: 2-[(4-bromo-2-ethyl-phenyl)sulfonylamino]acetic acid benzyl ester Formula: C17H18BrNO4S MolecularWeight: 412.29812

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=C1)Br)S(=O)(=O)NCC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CCC1=C(C=CC(=C1)Br)S(=O)(=O)NCC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C17H18BrNO4S/c1-2-14-10-15(18)8-9-16(14)24(21,22)19-11-17(20)23-12-13-6-4-3-5-7-13/h3-10,19H,2,11-12H2,1H3