N-[1-(1-adamantyl)ethyl]-2-(6-methyl-2-nitro-pyridin-3-yl)oxy-ethanamide

Systemtic Name: N-[1-(1-adamantyl)ethyl]-2-(6-methyl-2-nitro-pyridin-3-yl)oxy-ethanamide Openeye Name: N-[1-(1-adamantyl)ethyl]-2-[(6-methyl-2-nitro-3-pyridyl)oxy]acetamide CAS Name: N-[1-(1-adamantyl)ethyl]-2-[(6-methyl-2-nitro-3-pyridinyl)oxy]acetamide IUPAC Name: N-[1-(1-adamantyl)ethyl]-2-(6-methyl-2-nitropyridin-3-yl)oxyacetamide Traditional Name: N-[1-(1-adamantyl)ethyl]-2-[(6-methyl-2-nitro-3-pyridyl)oxy]acetamide Formula: C20H27N3O4 MolecularWeight: 373.44608

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C=C1)OCC(=O)NC(C)C23CC4CC(C2)CC(C4)C3)[N+](=O)[O-]

Isomeric SMILES

CC1=NC(=C(C=C1)OCC(=O)NC(C)C23CC4CC(C2)CC(C4)C3)[N+](=O)[O-]

InChI

InChI=1S/C20H27N3O4/c1-12-3-4-17(19(21-12)23(25)26)27-11-18(24)22-13(2)20-8-14-5-15(9-20)7-16(6-14)10-20/h3-4,13-16H,5-11H2,1-2H3,(H,22,24)