methyl 5-nitro-6-[(4-oxidanylcyclohexyl)amino]pyridine-3-carboxylate

Systemtic Name: methyl 5-nitro-6-[(4-oxidanylcyclohexyl)amino]pyridine-3-carboxylate Openeye Name: methyl 6-[(4-hydroxycyclohexyl)amino]-5-nitro-pyridine-3-carboxylate CAS Name: 6-[(4-hydroxycyclohexyl)amino]-5-nitro-3-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 6-[(4-hydroxycyclohexyl)amino]-5-nitropyridine-3-carboxylate Traditional Name: 6-[(4-hydroxycyclohexyl)amino]-5-nitro-nicotinic acid methyl ester Formula: C13H17N3O5 MolecularWeight: 295.29118

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(N=C1)NC2CCC(CC2)O)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=CC(=C(N=C1)NC2CCC(CC2)O)[N+](=O)[O-]

InChI

InChI=1S/C13H17N3O5/c1-21-13(18)8-6-11(16(19)20)12(14-7-8)15-9-2-4-10(17)5-3-9/h6-7,9-10,17H,2-5H2,1H3,(H,14,15)