(3S,4S,5S)-5-methyl-4-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxidanyl-heptanoic acid

Systemtic Name: (3S,4S,5S)-5-methyl-4-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxidanyl-heptanoic acid Openeye Name: (3S,4S,5S)-4-(tert-butoxycarbonylamino)-3-hydroxy-5-methyl-heptanoic acid CAS Name: (3S,4S,5S)-3-hydroxy-5-methyl-4-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]heptanoic acid IUPAC Name: (3S,4S,5S)-3-hydroxy-5-methyl-4-[(2-methylpropan-2-yl)oxycarbonylamino]heptanoic acid Traditional Name: (3S,4S,5S)-4-(tert-butoxycarbonylamino)-3-hydroxy-5-methyl-enanthic acid Formula: C13H25NO5 MolecularWeight: 275.3413

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(CC(=O)O)O)NC(=O)OC(C)(C)C

Isomeric SMILES

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

InChI

InChI=1S/C13H25NO5/c1-6-8(2)11(9(15)7-10(16)17)14-12(18)19-13(3,4)5/h8-9,11,15H,6-7H2,1-5H3,(H,14,18)(H,16,17)/t8-,9-,11-/m0/s1