3-(1-adamantyl)-1-(4-hydroxyphenyl)naphthalene-2-carboxylic acid

Systemtic Name: 3-(1-adamantyl)-1-(4-hydroxyphenyl)naphthalene-2-carboxylic acid Openeye Name: 3-(1-adamantyl)-1-(4-hydroxyphenyl)naphthalene-2-carboxylic acid CAS Name: 3-(1-adamantyl)-1-(4-hydroxyphenyl)-2-naphthalenecarboxylic acid IUPAC Name: 3-(1-adamantyl)-1-(4-hydroxyphenyl)naphthalene-2-carboxylic acid Traditional Name: 3-(1-adamantyl)-1-(4-hydroxyphenyl)-2-naphthoic acid Formula: C27H26O3 MolecularWeight: 398.49354

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C4=CC5=CC=CC=C5C(=C4C(=O)O)C6=CC=C(C=C6)O

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C4=CC5=CC=CC=C5C(=C4C(=O)O)C6=CC=C(C=C6)O

InChI

InChI=1S/C27H26O3/c28-21-7-5-19(6-8-21)24-22-4-2-1-3-20(22)12-23(25(24)26(29)30)27-13-16-9-17(14-27)11-18(10-16)15-27/h1-8,12,16-18,28H,9-11,13-15H2,(H,29,30)