tert-butyl (4S)-2-bromanyl-5-methyl-3-oxidanylidene-4-(phenylmethoxycarbonylamino)hexanoate

Systemtic Name: tert-butyl (4S)-2-bromanyl-5-methyl-3-oxidanylidene-4-(phenylmethoxycarbonylamino)hexanoate Openeye Name: tert-butyl (4S)-4-(benzyloxycarbonylamino)-2-bromo-5-methyl-3-oxo-hexanoate CAS Name: (4S)-2-bromo-5-methyl-3-oxo-4-(phenylmethoxycarbonylamino)hexanoic acid tert-butyl ester IUPAC Name: tert-butyl (4S)-2-bromo-5-methyl-3-oxo-4-(phenylmethoxycarbonylamino)hexanoate Traditional Name: (4S)-4-(benzyloxycarbonylamino)-2-bromo-3-keto-5-methyl-hexanoic acid tert-butyl ester Formula: C19H26BrNO5 MolecularWeight: 428.31744

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)C(C(=O)OC(C)(C)C)Br)NC(=O)OCC1=CC=CC=C1

Isomeric SMILES

CC(C)[C@@H](C(=O)C(C(=O)OC(C)(C)C)Br)NC(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C19H26BrNO5/c1-12(2)15(16(22)14(20)17(23)26-19(3,4)5)21-18(24)25-11-13-9-7-6-8-10-13/h6-10,12,14-15H,11H2,1-5H3,(H,21,24)/t14?,15-/m0/s1