methyl 2-[1-(5-bromanyl-2-oxidanyl-phenyl)propylamino]ethanoate

Systemtic Name: methyl 2-[1-(5-bromanyl-2-oxidanyl-phenyl)propylamino]ethanoate Openeye Name: methyl 2-[1-(5-bromo-2-hydroxy-phenyl)propylamino]acetate CAS Name: 2-[1-(5-bromo-2-hydroxyphenyl)propylamino]acetic acid methyl ester IUPAC Name: methyl 2-[1-(5-bromo-2-hydroxyphenyl)propylamino]acetate Traditional Name: 2-[1-(5-bromo-2-hydroxy-phenyl)propylamino]acetic acid methyl ester Formula: C12H16BrNO3 MolecularWeight: 302.16434

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=C(C=CC(=C1)Br)O)NCC(=O)OC

Isomeric SMILES

CCC(C1=C(C=CC(=C1)Br)O)NCC(=O)OC

InChI

InChI=1S/C12H16BrNO3/c1-3-10(14-7-12(16)17-2)9-6-8(13)4-5-11(9)15/h4-6,10,14-15H,3,7H2,1-2H3