methyl (3S)-5-(5-azanylpyridin-2-yl)-3-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoate

Systemtic Name: methyl (3S)-5-(5-azanylpyridin-2-yl)-3-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoate Openeye Name: methyl (3S)-5-(5-amino-2-pyridyl)-3-(tert-butoxycarbonylamino)pentanoate CAS Name: (3S)-5-(5-amino-2-pyridinyl)-3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]pentanoic acid methyl ester IUPAC Name: methyl (3S)-5-(5-aminopyridin-2-yl)-3-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoate Traditional Name: (3S)-5-(5-amino-2-pyridyl)-3-(tert-butoxycarbonylamino)valeric acid methyl ester Formula: C16H25N3O4 MolecularWeight: 323.3874

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CCC1=NC=C(C=C1)N)CC(=O)OC

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](CCC1=NC=C(C=C1)N)CC(=O)OC

InChI

InChI=1S/C16H25N3O4/c1-16(2,3)23-15(21)19-13(9-14(20)22-4)8-7-12-6-5-11(17)10-18-12/h5-6,10,13H,7-9,17H2,1-4H3,(H,19,21)/t13-/m0/s1