[2-(1-adamantyl)-6-methanoyl-phenyl] 4-methoxybenzoate

Systemtic Name: [2-(1-adamantyl)-6-methanoyl-phenyl] 4-methoxybenzoate Openeye Name: [2-(1-adamantyl)-6-formyl-phenyl] 4-methoxybenzoate CAS Name: 4-methoxybenzoic acid [2-(1-adamantyl)-6-formylphenyl] ester IUPAC Name: [2-(1-adamantyl)-6-formylphenyl] 4-methoxybenzoate Traditional Name: 4-methoxybenzoic acid [2-(1-adamantyl)-6-formyl-phenyl] ester Formula: C25H26O4 MolecularWeight: 390.47154

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)OC2=C(C=CC=C2C34CC5CC(C3)CC(C5)C4)C=O

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)OC2=C(C=CC=C2C34CC5CC(C3)CC(C5)C4)C=O

InChI

InChI=1S/C25H26O4/c1-28-21-7-5-19(6-8-21)24(27)29-23-20(15-26)3-2-4-22(23)25-12-16-9-17(13-25)11-18(10-16)14-25/h2-8,15-18H,9-14H2,1H3