methyl (2S)-2-(2-bromanylethanoylamino)-3-(4-hydroxyphenyl)propanoate

Systemtic Name: methyl (2S)-2-(2-bromanylethanoylamino)-3-(4-hydroxyphenyl)propanoate Openeye Name: methyl (2S)-2-[(2-bromoacetyl)amino]-3-(4-hydroxyphenyl)propanoate CAS Name: (2S)-2-[(2-bromo-1-oxoethyl)amino]-3-(4-hydroxyphenyl)propanoic acid methyl ester IUPAC Name: methyl (2S)-2-[(2-bromoacetyl)amino]-3-(4-hydroxyphenyl)propanoate Traditional Name: (2S)-2-[(2-bromoacetyl)amino]-3-(4-hydroxyphenyl)propionic acid methyl ester Formula: C12H14BrNO4 MolecularWeight: 316.14786

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=C(C=C1)O)NC(=O)CBr

Isomeric SMILES

COC(=O)[C@H](CC1=CC=C(C=C1)O)NC(=O)CBr

InChI

InChI=1S/C12H14BrNO4/c1-18-12(17)10(14-11(16)7-13)6-8-2-4-9(15)5-3-8/h2-5,10,15H,6-7H2,1H3,(H,14,16)/t10-/m0/s1