ethyl 2-azanyl-5-chloranyl-6-[(2,2-dimethyl-1-oxidanyl-propyl)amino]pyridine-3-carboxylate

Systemtic Name: ethyl 2-azanyl-5-chloranyl-6-[(2,2-dimethyl-1-oxidanyl-propyl)amino]pyridine-3-carboxylate Openeye Name: ethyl 2-amino-5-chloro-6-[(1-hydroxy-2,2-dimethyl-propyl)amino]pyridine-3-carboxylate CAS Name: 2-amino-5-chloro-6-[(1-hydroxy-2,2-dimethylpropyl)amino]-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-amino-5-chloro-6-[(1-hydroxy-2,2-dimethylpropyl)amino]pyridine-3-carboxylate Traditional Name: 2-amino-5-chloro-6-[(1-hydroxy-2,2-dimethyl-propyl)amino]nicotinic acid ethyl ester Formula: C13H20ClN3O3 MolecularWeight: 301.7692

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(N=C1N)NC(C(C)(C)C)O)Cl

Isomeric SMILES

CCOC(=O)C1=CC(=C(N=C1N)NC(C(C)(C)C)O)Cl

InChI

InChI=1S/C13H20ClN3O3/c1-5-20-11(18)7-6-8(14)10(16-9(7)15)17-12(19)13(2,3)4/h6,12,19H,5H2,1-4H3,(H3,15,16,17)