methyl 2-[[5-(hydroxymethyl)-2-methyl-3-oxidanyl-pyridin-4-yl]methylamino]-5-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoate

Systemtic Name: methyl 2-[[5-(hydroxymethyl)-2-methyl-3-oxidanyl-pyridin-4-yl]methylamino]-5-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoate Openeye Name: methyl 5-(tert-butoxycarbonylamino)-2-[[3-hydroxy-5-(hydroxymethyl)-2-methyl-4-pyridyl]methylamino]pentanoate CAS Name: 2-[[3-hydroxy-5-(hydroxymethyl)-2-methyl-4-pyridinyl]methylamino]-5-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]pentanoic acid methyl ester IUPAC Name: methyl 2-[[3-hydroxy-5-(hydroxymethyl)-2-methylpyridin-4-yl]methylamino]-5-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoate Traditional Name: 5-(tert-butoxycarbonylamino)-2-[(3-hydroxy-2-methyl-5-methylol-4-pyridyl)methylamino]valeric acid methyl ester Formula: C19H31N3O6 MolecularWeight: 397.46594

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C(=C1O)CNC(CCCNC(=O)OC(C)(C)C)C(=O)OC)CO

Isomeric SMILES

CC1=NC=C(C(=C1O)CNC(CCCNC(=O)OC(C)(C)C)C(=O)OC)CO

InChI

InChI=1S/C19H31N3O6/c1-12-16(24)14(13(11-23)9-21-12)10-22-15(17(25)27-5)7-6-8-20-18(26)28-19(2,3)4/h9,15,22-24H,6-8,10-11H2,1-5H3,(H,20,26)