3-(1-adamantyl)-1-(2-methylphenyl)-4-oxidanyl-naphthalene-2-carboxylic acid

Systemtic Name: 3-(1-adamantyl)-1-(2-methylphenyl)-4-oxidanyl-naphthalene-2-carboxylic acid Openeye Name: 3-(1-adamantyl)-4-hydroxy-1-(o-tolyl)naphthalene-2-carboxylic acid CAS Name: 3-(1-adamantyl)-4-hydroxy-1-(2-methylphenyl)-2-naphthalenecarboxylic acid IUPAC Name: 3-(1-adamantyl)-4-hydroxy-1-(2-methylphenyl)naphthalene-2-carboxylic acid Traditional Name: 3-(1-adamantyl)-4-hydroxy-1-(o-tolyl)-2-naphthoic acid Formula: C28H28O3 MolecularWeight: 412.52012

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=C(C(=C(C3=CC=CC=C32)O)C45CC6CC(C4)CC(C6)C5)C(=O)O

Isomeric SMILES

CC1=CC=CC=C1C2=C(C(=C(C3=CC=CC=C32)O)C45CC6CC(C4)CC(C6)C5)C(=O)O

InChI

InChI=1S/C28H28O3/c1-16-6-2-3-7-20(16)23-21-8-4-5-9-22(21)26(29)25(24(23)27(30)31)28-13-17-10-18(14-28)12-19(11-17)15-28/h2-9,17-19,29H,10-15H2,1H3,(H,30,31)