2-chloranyl-3-[(2-methylpropan-2-yl)oxycarbonylamino]pyridine-4-carboxylic acid

Systemtic Name: 2-chloranyl-3-[(2-methylpropan-2-yl)oxycarbonylamino]pyridine-4-carboxylic acid Openeye Name: 3-(tert-butoxycarbonylamino)-2-chloro-pyridine-4-carboxylic acid CAS Name: 2-chloro-3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-4-pyridinecarboxylic acid IUPAC Name: 2-chloro-3-[(2-methylpropan-2-yl)oxycarbonylamino]pyridine-4-carboxylic acid Traditional Name: 3-(tert-butoxycarbonylamino)-2-chloro-isonicotinic acid Formula: C11H13ClN2O4 MolecularWeight: 272.68492

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1=C(C=CN=C1Cl)C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)NC1=C(C=CN=C1Cl)C(=O)O

InChI

InChI=1S/C11H13ClN2O4/c1-11(2,3)18-10(17)14-7-6(9(15)16)4-5-13-8(7)12/h4-5H,1-3H3,(H,14,17)(H,15,16)