1-[6-[7-(2-adamantyl)-6-(2-methoxyethoxymethoxy)naphthalen-2-yl]pyridin-3-yl]ethanone

Systemtic Name: 1-[6-[7-(2-adamantyl)-6-(2-methoxyethoxymethoxy)naphthalen-2-yl]pyridin-3-yl]ethanone Openeye Name: 1-[6-[7-(2-adamantyl)-6-(2-methoxyethoxymethoxy)-2-naphthyl]-3-pyridyl]ethanone CAS Name: 1-[6-[7-(2-adamantyl)-6-(2-methoxyethoxymethoxy)-2-naphthalenyl]-3-pyridinyl]ethanone IUPAC Name: 1-[6-[7-(2-adamantyl)-6-(2-methoxyethoxymethoxy)naphthalen-2-yl]pyridin-3-yl]ethanone Traditional Name: 1-[6-[7-(2-adamantyl)-6-(2-methoxyethoxymethoxy)-2-naphthyl]-3-pyridyl]ethanone Formula: C31H35NO4 MolecularWeight: 485.6139

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CN=C(C=C1)C2=CC3=CC(=C(C=C3C=C2)OCOCCOC)C4C5CC6CC(C5)CC4C6

Isomeric SMILES

CC(=O)C1=CN=C(C=C1)C2=CC3=CC(=C(C=C3C=C2)OCOCCOC)C4C5CC6CC(C5)CC4C6

InChI

InChI=1S/C31H35NO4/c1-19(33)24-5-6-29(32-17-24)23-4-3-22-16-30(36-18-35-8-7-34-2)28(15-25(22)14-23)31-26-10-20-9-21(12-26)13-27(31)11-20/h3-6,14-17,20-21,26-27,31H,7-13,18H2,1-2H3