(6-methyl-3-nitro-2-oxidanylidene-1H-pyridin-4-yl) adamantane-1-carboxylate

Systemtic Name: (6-methyl-3-nitro-2-oxidanylidene-1H-pyridin-4-yl) adamantane-1-carboxylate Openeye Name: (6-methyl-3-nitro-2-oxo-1H-pyridin-4-yl) adamantane-1-carboxylate CAS Name: 1-adamantanecarboxylic acid (6-methyl-3-nitro-2-oxo-1H-pyridin-4-yl) ester IUPAC Name: (6-methyl-3-nitro-2-oxo-1H-pyridin-4-yl) adamantane-1-carboxylate Traditional Name: adamantane-1-carboxylic acid (2-keto-6-methyl-3-nitro-1H-pyridin-4-yl) ester Formula: C17H20N2O5 MolecularWeight: 332.3511

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=O)N1)[N+](=O)[O-])OC(=O)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CC1=CC(=C(C(=O)N1)[N+](=O)[O-])OC(=O)C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C17H20N2O5/c1-9-2-13(14(19(22)23)15(20)18-9)24-16(21)17-6-10-3-11(7-17)5-12(4-10)8-17/h2,10-12H,3-8H2,1H3,(H,18,20)