6-[(3-hexoxy-5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)selanyl]pyridine-3-carboxylic acid

Systemtic Name: 6-[(3-hexoxy-5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)selanyl]pyridine-3-carboxylic acid Openeye Name: 6-(7-hexoxy-1,1,4,4-tetramethyl-tetralin-6-yl)selanylpyridine-3-carboxylic acid CAS Name: 6-[(3-hexoxy-5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)seleno]-3-pyridinecarboxylic acid IUPAC Name: 6-[(3-hexoxy-5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)selanyl]pyridine-3-carboxylic acid Traditional Name: 6-[(7-hexoxy-1,1,4,4-tetramethyl-tetralin-6-yl)seleno]nicotinic acid Formula: C26H35NO3Se MolecularWeight: 488.521

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C=C2C(=C1)C(CCC2(C)C)(C)C)[Se]C3=NC=C(C=C3)C(=O)O

Isomeric SMILES

CCCCCCOC1=C(C=C2C(=C1)C(CCC2(C)C)(C)C)[Se]C3=NC=C(C=C3)C(=O)O

InChI

InChI=1S/C26H35NO3Se/c1-6-7-8-9-14-30-21-15-19-20(26(4,5)13-12-25(19,2)3)16-22(21)31-23-11-10-18(17-27-23)24(28)29/h10-11,15-17H,6-9,12-14H2,1-5H3,(H,28,29)