(phenylmethyl) 2-[(5-bromanyl-2-methoxy-phenyl)sulfonylamino]ethanoate

Systemtic Name: (phenylmethyl) 2-[(5-bromanyl-2-methoxy-phenyl)sulfonylamino]ethanoate Openeye Name: benzyl 2-[(5-bromo-2-methoxy-phenyl)sulfonylamino]acetate CAS Name: 2-[(5-bromo-2-methoxyphenyl)sulfonylamino]acetic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[(5-bromo-2-methoxyphenyl)sulfonylamino]acetate Traditional Name: 2-[(5-bromo-2-methoxy-phenyl)sulfonylamino]acetic acid benzyl ester Formula: C16H16BrNO5S MolecularWeight: 414.27094

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)S(=O)(=O)NCC(=O)OCC2=CC=CC=C2

Isomeric SMILES

COC1=C(C=C(C=C1)Br)S(=O)(=O)NCC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C16H16BrNO5S/c1-22-14-8-7-13(17)9-15(14)24(20,21)18-10-16(19)23-11-12-5-3-2-4-6-12/h2-9,18H,10-11H2,1H3