methyl (4S,5S)-7-methyl-5-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxidanyl-oct-2-ynoate

Systemtic Name: methyl (4S,5S)-7-methyl-5-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxidanyl-oct-2-ynoate Openeye Name: methyl (4S,5S)-5-(tert-butoxycarbonylamino)-4-hydroxy-7-methyl-oct-2-ynoate CAS Name: (4S,5S)-4-hydroxy-7-methyl-5-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-2-octynoic acid methyl ester IUPAC Name: methyl (4S,5S)-4-hydroxy-7-methyl-5-[(2-methylpropan-2-yl)oxycarbonylamino]oct-2-ynoate Traditional Name: (4S,5S)-5-(tert-butoxycarbonylamino)-4-hydroxy-7-methyl-oct-2-ynoic acid methyl ester Formula: C15H25NO5 MolecularWeight: 299.3627

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H25NO5/c1-10(2)9-11(12(17)7-8-13(18)20-6)16-14(19)21-15(3,4)5/h10-12,17H,9H2,1-6H3,(H,16,19)/t11-,12-/m0/s1