[7-(1-adamantyl)-6-[ethoxy(methoxy)methoxy]naphthalen-2-yl] pyridine-3-carboxylate

Systemtic Name: [7-(1-adamantyl)-6-[ethoxy(methoxy)methoxy]naphthalen-2-yl] pyridine-3-carboxylate Openeye Name: [7-(1-adamantyl)-6-[ethoxy(methoxy)methoxy]-2-naphthyl] pyridine-3-carboxylate CAS Name: 3-pyridinecarboxylic acid [7-(1-adamantyl)-6-[ethoxy(methoxy)methoxy]-2-naphthalenyl] ester IUPAC Name: [7-(1-adamantyl)-6-[ethoxy(methoxy)methoxy]naphthalen-2-yl] pyridine-3-carboxylate Traditional Name: nicotinic acid [7-(1-adamantyl)-6-[ethoxy(methoxy)methoxy]-2-naphthyl] ester Formula: C30H33NO5 MolecularWeight: 487.58672

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(OC)OC1=C(C=C2C=C(C=CC2=C1)OC(=O)C3=CN=CC=C3)C45CC6CC(C4)CC(C6)C5

Isomeric SMILES

CCOC(OC)OC1=C(C=C2C=C(C=CC2=C1)OC(=O)C3=CN=CC=C3)C45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C30H33NO5/c1-3-34-29(33-2)36-27-14-22-6-7-25(35-28(32)23-5-4-8-31-18-23)12-24(22)13-26(27)30-15-19-9-20(16-30)11-21(10-19)17-30/h4-8,12-14,18-21,29H,3,9-11,15-17H2,1-2H3