(4-bromophenyl) (2R,3S)-4-methyl-3-oxidanyl-2-(phenylmethoxycarbonylamino)pentanoate

Systemtic Name: (4-bromophenyl) (2R,3S)-4-methyl-3-oxidanyl-2-(phenylmethoxycarbonylamino)pentanoate Openeye Name: (4-bromophenyl) (2R,3S)-2-(benzyloxycarbonylamino)-3-hydroxy-4-methyl-pentanoate CAS Name: (2R,3S)-3-hydroxy-4-methyl-2-(phenylmethoxycarbonylamino)pentanoic acid (4-bromophenyl) ester IUPAC Name: (4-bromophenyl) (2R,3S)-3-hydroxy-4-methyl-2-(phenylmethoxycarbonylamino)pentanoate Traditional Name: (2R,3S)-2-(benzyloxycarbonylamino)-3-hydroxy-4-methyl-valeric acid (4-bromophenyl) ester Formula: C20H22BrNO5 MolecularWeight: 436.29638

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(C(=O)OC1=CC=C(C=C1)Br)NC(=O)OCC2=CC=CC=C2)O

Isomeric SMILES

CC(C)[C@@H]([C@H](C(=O)OC1=CC=C(C=C1)Br)NC(=O)OCC2=CC=CC=C2)O

InChI

InChI=1S/C20H22BrNO5/c1-13(2)18(23)17(19(24)27-16-10-8-15(21)9-11-16)22-20(25)26-12-14-6-4-3-5-7-14/h3-11,13,17-18,23H,12H2,1-2H3,(H,22,25)/t17-,18+/m1/s1