6-(1-adamantyl)-4-(3-decoxyphenyl)naphthalene-2-carboxylic acid

Systemtic Name: 6-(1-adamantyl)-4-(3-decoxyphenyl)naphthalene-2-carboxylic acid Openeye Name: 6-(1-adamantyl)-4-(3-decoxyphenyl)naphthalene-2-carboxylic acid CAS Name: 6-(1-adamantyl)-4-(3-decoxyphenyl)-2-naphthalenecarboxylic acid IUPAC Name: 6-(1-adamantyl)-4-(3-decoxyphenyl)naphthalene-2-carboxylic acid Traditional Name: 6-(1-adamantyl)-4-(3-decoxyphenyl)-2-naphthoic acid Formula: C37H46O3 MolecularWeight: 538.75934

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=CC=CC(=C1)C2=C3C=C(C=CC3=CC(=C2)C(=O)O)C45CC6CC(C4)CC(C6)C5

Isomeric SMILES

CCCCCCCCCCOC1=CC=CC(=C1)C2=C3C=C(C=CC3=CC(=C2)C(=O)O)C45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C37H46O3/c1-2-3-4-5-6-7-8-9-15-40-33-12-10-11-29(20-33)34-21-31(36(38)39)19-30-13-14-32(22-35(30)34)37-23-26-16-27(24-37)18-28(17-26)25-37/h10-14,19-22,26-28H,2-9,15-18,23-25H2,1H3,(H,38,39)