methyl (2S)-3-(4-bromanyl-3-methyl-phenyl)-2-(phenylmethoxycarbonylamino)propanoate

Systemtic Name: methyl (2S)-3-(4-bromanyl-3-methyl-phenyl)-2-(phenylmethoxycarbonylamino)propanoate Openeye Name: methyl (2S)-2-(benzyloxycarbonylamino)-3-(4-bromo-3-methyl-phenyl)propanoate CAS Name: (2S)-3-(4-bromo-3-methylphenyl)-2-(phenylmethoxycarbonylamino)propanoic acid methyl ester IUPAC Name: methyl (2S)-3-(4-bromo-3-methylphenyl)-2-(phenylmethoxycarbonylamino)propanoate Traditional Name: (2S)-2-(benzyloxycarbonylamino)-3-(4-bromo-3-methyl-phenyl)propionic acid methyl ester Formula: C19H20BrNO4 MolecularWeight: 406.2704

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H20BrNO4/c1-13-10-15(8-9-16(13)20)11-17(18(22)24-2)21-19(23)25-12-14-6-4-3-5-7-14/h3-10,17H,11-12H2,1-2H3,(H,21,23)/t17-/m0/s1