(2S,3R)-3-chloranyl-4-methyl-2-(phenylmethoxycarbonylamino)pentanoic acid

Systemtic Name: (2S,3R)-3-chloranyl-4-methyl-2-(phenylmethoxycarbonylamino)pentanoic acid Openeye Name: (2S,3R)-2-(benzyloxycarbonylamino)-3-chloro-4-methyl-pentanoic acid CAS Name: (2S,3R)-3-chloro-4-methyl-2-(phenylmethoxycarbonylamino)pentanoic acid IUPAC Name: (2S,3R)-3-chloro-4-methyl-2-(phenylmethoxycarbonylamino)pentanoic acid Traditional Name: (2S,3R)-2-(benzyloxycarbonylamino)-3-chloro-4-methyl-valeric acid Formula: C14H18ClNO4 MolecularWeight: 299.75002

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(C(=O)O)NC(=O)OCC1=CC=CC=C1)Cl

Isomeric SMILES

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

InChI

InChI=1S/C14H18ClNO4/c1-9(2)11(15)12(13(17)18)16-14(19)20-8-10-6-4-3-5-7-10/h3-7,9,11-12H,8H2,1-2H3,(H,16,19)(H,17,18)/t11-,12-/m1/s1