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

Systemtic Name: [7-(1-adamantyl)-6-heptoxy-naphthalen-2-yl] benzoate Openeye Name: [7-(1-adamantyl)-6-heptoxy-2-naphthyl] benzoate CAS Name: benzoic acid [7-(1-adamantyl)-6-heptoxy-2-naphthalenyl] ester IUPAC Name: [7-(1-adamantyl)-6-heptoxynaphthalen-2-yl] benzoate Traditional Name: benzoic acid [7-(1-adamantyl)-6-heptoxy-2-naphthyl] ester Formula: C34H40O3 MolecularWeight: 496.6796

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=C(C=C2C=C(C=CC2=C1)OC(=O)C3=CC=CC=C3)C45CC6CC(C4)CC(C6)C5

Isomeric SMILES

CCCCCCCOC1=C(C=C2C=C(C=CC2=C1)OC(=O)C3=CC=CC=C3)C45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C34H40O3/c1-2-3-4-5-9-14-36-32-20-28-12-13-30(37-33(35)27-10-7-6-8-11-27)18-29(28)19-31(32)34-21-24-15-25(22-34)17-26(16-24)23-34/h6-8,10-13,18-20,24-26H,2-5,9,14-17,21-23H2,1H3