6-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]pyridine-3-carboxylic acid

Systemtic Name: 6-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]pyridine-3-carboxylic acid Openeye Name: 6-[(tert-butoxycarbonylamino)methyl]pyridine-3-carboxylic acid CAS Name: 6-[[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]methyl]-3-pyridinecarboxylic acid IUPAC Name: 6-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]pyridine-3-carboxylic acid Traditional Name: 6-[(tert-butoxycarbonylamino)methyl]nicotinic acid Formula: C12H16N2O4 MolecularWeight: 252.26644

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCC1=NC=C(C=C1)C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)NCC1=NC=C(C=C1)C(=O)O

InChI

InChI=1S/C12H16N2O4/c1-12(2,3)18-11(17)14-7-9-5-4-8(6-13-9)10(15)16/h4-6H,7H2,1-3H3,(H,14,17)(H,15,16)