[7-(1-adamantyl)-1-(6-oxidanylheptoxy)naphthalen-2-yl] benzoate

Systemtic Name: [7-(1-adamantyl)-1-(6-oxidanylheptoxy)naphthalen-2-yl] benzoate Openeye Name: [7-(1-adamantyl)-1-(6-hydroxyheptoxy)-2-naphthyl] benzoate CAS Name: benzoic acid [7-(1-adamantyl)-1-(6-hydroxyheptoxy)-2-naphthalenyl] ester IUPAC Name: [7-(1-adamantyl)-1-(6-hydroxyheptoxy)naphthalen-2-yl] benzoate Traditional Name: benzoic acid [7-(1-adamantyl)-1-(6-hydroxyheptoxy)-2-naphthyl] ester Formula: C34H40O4 MolecularWeight: 512.679

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCCCOC1=C(C=CC2=C1C=C(C=C2)C34CC5CC(C3)CC(C5)C4)OC(=O)C6=CC=CC=C6)O

Isomeric SMILES

CC(CCCCCOC1=C(C=CC2=C1C=C(C=C2)C34CC5CC(C3)CC(C5)C4)OC(=O)C6=CC=CC=C6)O

InChI

InChI=1S/C34H40O4/c1-23(35)8-4-3-7-15-37-32-30-19-29(34-20-24-16-25(21-34)18-26(17-24)22-34)13-11-27(30)12-14-31(32)38-33(36)28-9-5-2-6-10-28/h2,5-6,9-14,19,23-26,35H,3-4,7-8,15-18,20-22H2,1H3