(4-bromophenyl)methyl (2S)-2-[(3-methylphenyl)carbonylamino]propanoate

Systemtic Name: (4-bromophenyl)methyl (2S)-2-[(3-methylphenyl)carbonylamino]propanoate Openeye Name: (4-bromophenyl)methyl (2S)-2-[(3-methylbenzoyl)amino]propanoate CAS Name: (2S)-2-[[(3-methylphenyl)-oxomethyl]amino]propanoic acid (4-bromophenyl)methyl ester IUPAC Name: (4-bromophenyl)methyl (2S)-2-[(3-methylbenzoyl)amino]propanoate Traditional Name: (2S)-2-(m-toluoylamino)propionic acid (4-bromobenzyl) ester Formula: C18H18BrNO3 MolecularWeight: 376.24442

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NC(C)C(=O)OCC2=CC=C(C=C2)Br

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)N[C@@H](C)C(=O)OCC2=CC=C(C=C2)Br

InChI

InChI=1S/C18H18BrNO3/c1-12-4-3-5-15(10-12)17(21)20-13(2)18(22)23-11-14-6-8-16(19)9-7-14/h3-10,13H,11H2,1-2H3,(H,20,21)/t13-/m0/s1