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

Systemtic Name: (3-cyanophenyl)methyl (2S)-2-[(4-bromophenyl)carbonylamino]propanoate Openeye Name: (3-cyanophenyl)methyl (2S)-2-[(4-bromobenzoyl)amino]propanoate CAS Name: (2S)-2-[[(4-bromophenyl)-oxomethyl]amino]propanoic acid (3-cyanophenyl)methyl ester IUPAC Name: (3-cyanophenyl)methyl (2S)-2-[(4-bromobenzoyl)amino]propanoate Traditional Name: (2S)-2-[(4-bromobenzoyl)amino]propionic acid (3-cyanobenzyl) ester Formula: C18H15BrN2O3 MolecularWeight: 387.2273

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OCC1=CC=CC(=C1)C#N)NC(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

C[C@@H](C(=O)OCC1=CC=CC(=C1)C#N)NC(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C18H15BrN2O3/c1-12(21-17(22)15-5-7-16(19)8-6-15)18(23)24-11-14-4-2-3-13(9-14)10-20/h2-9,12H,11H2,1H3,(H,21,22)/t12-/m0/s1