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

Systemtic Name: 3-(1-adamantyl)-1-[4-(3-oxidanylpropyl)phenyl]naphthalene-2-carboxylic acid Openeye Name: 3-(1-adamantyl)-1-[4-(3-hydroxypropyl)phenyl]naphthalene-2-carboxylic acid CAS Name: 3-(1-adamantyl)-1-[4-(3-hydroxypropyl)phenyl]-2-naphthalenecarboxylic acid IUPAC Name: 3-(1-adamantyl)-1-[4-(3-hydroxypropyl)phenyl]naphthalene-2-carboxylic acid Traditional Name: 3-(1-adamantyl)-1-[4-(3-hydroxypropyl)phenyl]-2-naphthoic acid Formula: C30H32O3 MolecularWeight: 440.57328

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C4=CC5=CC=CC=C5C(=C4C(=O)O)C6=CC=C(C=C6)CCCO

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C4=CC5=CC=CC=C5C(=C4C(=O)O)C6=CC=C(C=C6)CCCO

InChI

InChI=1S/C30H32O3/c31-11-3-4-19-7-9-23(10-8-19)27-25-6-2-1-5-24(25)15-26(28(27)29(32)33)30-16-20-12-21(17-30)14-22(13-20)18-30/h1-2,5-10,15,20-22,31H,3-4,11-14,16-18H2,(H,32,33)