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

Systemtic Name: 2-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethylamino]pyridine-3-carboxylic acid Openeye Name: 2-[2-(tert-butoxycarbonylamino)ethylamino]pyridine-3-carboxylic acid CAS Name: 2-[2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]ethylamino]-3-pyridinecarboxylic acid IUPAC Name: 2-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethylamino]pyridine-3-carboxylic acid Traditional Name: 2-[2-(tert-butoxycarbonylamino)ethylamino]nicotinic acid Formula: C13H19N3O4 MolecularWeight: 281.30766

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCNC1=C(C=CC=N1)C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)NCCNC1=C(C=CC=N1)C(=O)O

InChI

InChI=1S/C13H19N3O4/c1-13(2,3)20-12(19)16-8-7-15-10-9(11(17)18)5-4-6-14-10/h4-6H,7-8H2,1-3H3,(H,14,15)(H,16,19)(H,17,18)