6-[3-(1-adamantyl)-4-(3-oxidanylpropoxy)phenyl]naphthalene-2-carboxylic acid

Systemtic Name: 6-[3-(1-adamantyl)-4-(3-oxidanylpropoxy)phenyl]naphthalene-2-carboxylic acid Openeye Name: 6-[3-(1-adamantyl)-4-(3-hydroxypropoxy)phenyl]naphthalene-2-carboxylic acid CAS Name: 6-[3-(1-adamantyl)-4-(3-hydroxypropoxy)phenyl]-2-naphthalenecarboxylic acid IUPAC Name: 6-[3-(1-adamantyl)-4-(3-hydroxypropoxy)phenyl]naphthalene-2-carboxylic acid Traditional Name: 6-[3-(1-adamantyl)-4-(3-hydroxypropoxy)phenyl]-2-naphthoic acid Formula: C30H32O4 MolecularWeight: 456.57268

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C4=C(C=CC(=C4)C5=CC6=C(C=C5)C=C(C=C6)C(=O)O)OCCCO

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C4=C(C=CC(=C4)C5=CC6=C(C=C5)C=C(C=C6)C(=O)O)OCCCO

InChI

InChI=1S/C30H32O4/c31-8-1-9-34-28-7-6-25(23-2-3-24-14-26(29(32)33)5-4-22(24)13-23)15-27(28)30-16-19-10-20(17-30)12-21(11-19)18-30/h2-7,13-15,19-21,31H,1,8-12,16-18H2,(H,32,33)