3-(1-adamantyl)-2-(4-methoxyphenyl)benzoic acid

Systemtic Name: 3-(1-adamantyl)-2-(4-methoxyphenyl)benzoic acid Openeye Name: 3-(1-adamantyl)-2-(4-methoxyphenyl)benzoic acid CAS Name: 3-(1-adamantyl)-2-(4-methoxyphenyl)benzoic acid IUPAC Name: 3-(1-adamantyl)-2-(4-methoxyphenyl)benzoic acid Traditional Name: 3-(1-adamantyl)-2-(4-methoxyphenyl)benzoic acid Formula: C24H26O3 MolecularWeight: 362.46144

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=C(C=CC=C2C34CC5CC(C3)CC(C5)C4)C(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)C2=C(C=CC=C2C34CC5CC(C3)CC(C5)C4)C(=O)O

InChI

InChI=1S/C24H26O3/c1-27-19-7-5-18(6-8-19)22-20(23(25)26)3-2-4-21(22)24-12-15-9-16(13-24)11-17(10-15)14-24/h2-8,15-17H,9-14H2,1H3,(H,25,26)