methyl 2-[(4-bromophenyl)sulfonyl-phenethyl-amino]ethanoate

Systemtic Name: methyl 2-[(4-bromophenyl)sulfonyl-phenethyl-amino]ethanoate Openeye Name: methyl 2-[(4-bromophenyl)sulfonyl-phenethyl-amino]acetate CAS Name: 2-[(4-bromophenyl)sulfonyl-phenethylamino]acetic acid methyl ester IUPAC Name: methyl 2-[(4-bromophenyl)sulfonyl-phenethylamino]acetate Traditional Name: 2-[brosyl(phenethyl)amino]acetic acid methyl ester Formula: C17H18BrNO4S MolecularWeight: 412.29812

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CN(CCC1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

COC(=O)CN(CCC1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C17H18BrNO4S/c1-23-17(20)13-19(12-11-14-5-3-2-4-6-14)24(21,22)16-9-7-15(18)8-10-16/h2-10H,11-13H2,1H3