4-[7-(1-adamantyl)-6-(1-hydroxyethyl)naphthalen-2-yl]benzoic acid

Systemtic Name: 4-[7-(1-adamantyl)-6-(1-hydroxyethyl)naphthalen-2-yl]benzoic acid Openeye Name: 4-[7-(1-adamantyl)-6-(1-hydroxyethyl)-2-naphthyl]benzoic acid CAS Name: 4-[7-(1-adamantyl)-6-(1-hydroxyethyl)-2-naphthalenyl]benzoic acid IUPAC Name: 4-[7-(1-adamantyl)-6-(1-hydroxyethyl)naphthalen-2-yl]benzoic acid Traditional Name: 4-[7-(1-adamantyl)-6-(1-hydroxyethyl)-2-naphthyl]benzoic acid Formula: C29H30O3 MolecularWeight: 426.5467

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H30O3/c1-17(30)26-12-24-7-6-23(21-2-4-22(5-3-21)28(31)32)11-25(24)13-27(26)29-14-18-8-19(15-29)10-20(9-18)16-29/h2-7,11-13,17-20,30H,8-10,14-16H2,1H3,(H,31,32)