methyl 2-[3-bromanylbut-3-enyl-(phenylmethyl)amino]ethanoate

Systemtic Name: methyl 2-[3-bromanylbut-3-enyl-(phenylmethyl)amino]ethanoate Openeye Name: methyl 2-[benzyl(3-bromobut-3-enyl)amino]acetate CAS Name: 2-[3-bromobut-3-enyl-(phenylmethyl)amino]acetic acid methyl ester IUPAC Name: methyl 2-[benzyl(3-bromobut-3-enyl)amino]acetate Traditional Name: 2-[benzyl(3-bromobut-3-enyl)amino]acetic acid methyl ester Formula: C14H18BrNO2 MolecularWeight: 312.20222

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CN(CCC(=C)Br)CC1=CC=CC=C1

Isomeric SMILES

COC(=O)CN(CCC(=C)Br)CC1=CC=CC=C1

InChI

InChI=1S/C14H18BrNO2/c1-12(15)8-9-16(11-14(17)18-2)10-13-6-4-3-5-7-13/h3-7H,1,8-11H2,2H3