1-(1-adamantyl)-2-(4-methyl-2-nitro-phenoxy)ethanone

Systemtic Name: 1-(1-adamantyl)-2-(4-methyl-2-nitro-phenoxy)ethanone Openeye Name: 1-(1-adamantyl)-2-(4-methyl-2-nitro-phenoxy)ethanone CAS Name: 1-(1-adamantyl)-2-(4-methyl-2-nitrophenoxy)ethanone IUPAC Name: 1-(1-adamantyl)-2-(4-methyl-2-nitrophenoxy)ethanone Traditional Name: 1-(1-adamantyl)-2-(4-methyl-2-nitro-phenoxy)ethanone Formula: C19H23NO4 MolecularWeight: 329.39022

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H23NO4/c1-12-2-3-17(16(4-12)20(22)23)24-11-18(21)19-8-13-5-14(9-19)7-15(6-13)10-19/h2-4,13-15H,5-11H2,1H3