2,2,6,9-tetramethyl-4-naphthalen-2-yl-9-(3-oxidanyl-1-adamantyl)-7-oxidanylidene-decanoic acid

Systemtic Name: 2,2,6,9-tetramethyl-4-naphthalen-2-yl-9-(3-oxidanyl-1-adamantyl)-7-oxidanylidene-decanoic acid Openeye Name: 9-(3-hydroxy-1-adamantyl)-2,2,6,9-tetramethyl-4-(2-naphthyl)-7-oxo-decanoic acid CAS Name: 9-(3-hydroxy-1-adamantyl)-2,2,6,9-tetramethyl-4-(2-naphthalenyl)-7-oxodecanoic acid IUPAC Name: 9-(3-hydroxy-1-adamantyl)-2,2,6,9-tetramethyl-4-naphthalen-2-yl-7-oxodecanoic acid Traditional Name: 9-(3-hydroxy-1-adamantyl)-7-keto-2,2,6,9-tetramethyl-4-(2-naphthyl)capric acid Formula: C34H46O4 MolecularWeight: 518.72664

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(CC(C)(C)C(=O)O)C1=CC2=CC=CC=C2C=C1)C(=O)CC(C)(C)C34CC5CC(C3)CC(C5)(C4)O

Isomeric SMILES

CC(CC(CC(C)(C)C(=O)O)C1=CC2=CC=CC=C2C=C1)C(=O)CC(C)(C)C34CC5CC(C3)CC(C5)(C4)O

InChI

InChI=1S/C34H46O4/c1-22(29(35)20-32(4,5)33-15-23-13-24(16-33)18-34(38,17-23)21-33)12-28(19-31(2,3)30(36)37)27-11-10-25-8-6-7-9-26(25)14-27/h6-11,14,22-24,28,38H,12-13,15-21H2,1-5H3,(H,36,37)