methyl 2-[(5-bromanyl-2-ethoxy-phenyl)sulfonyl-methyl-amino]ethanoate

Systemtic Name: methyl 2-[(5-bromanyl-2-ethoxy-phenyl)sulfonyl-methyl-amino]ethanoate Openeye Name: methyl 2-[(5-bromo-2-ethoxy-phenyl)sulfonyl-methyl-amino]acetate CAS Name: 2-[(5-bromo-2-ethoxyphenyl)sulfonyl-methylamino]acetic acid methyl ester IUPAC Name: methyl 2-[(5-bromo-2-ethoxyphenyl)sulfonyl-methylamino]acetate Traditional Name: 2-[(5-bromo-2-ethoxy-phenyl)sulfonyl-methyl-amino]acetic acid methyl ester Formula: C12H16BrNO5S MolecularWeight: 366.22814

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)Br)S(=O)(=O)N(C)CC(=O)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)Br)S(=O)(=O)N(C)CC(=O)OC

InChI

InChI=1S/C12H16BrNO5S/c1-4-19-10-6-5-9(13)7-11(10)20(16,17)14(2)8-12(15)18-3/h5-7H,4,8H2,1-3H3