6-[4-(5-decylpyrimidin-2-yl)phenyl]carbonyloxy-1,2,3,4-tetrahydronaphthalene-2-carboxylic acid

Systemtic Name: 6-[4-(5-decylpyrimidin-2-yl)phenyl]carbonyloxy-1,2,3,4-tetrahydronaphthalene-2-carboxylic acid Openeye Name: 6-[4-(5-decylpyrimidin-2-yl)benzoyl]oxytetralin-2-carboxylic acid CAS Name: 6-[[4-(5-decyl-2-pyrimidinyl)phenyl]-oxomethoxy]-1,2,3,4-tetrahydronaphthalene-2-carboxylic acid IUPAC Name: 6-[4-(5-decylpyrimidin-2-yl)benzoyl]oxy-1,2,3,4-tetrahydronaphthalene-2-carboxylic acid Traditional Name: 6-[4-(5-decylpyrimidin-2-yl)benzoyl]oxytetralin-2-carboxylic acid Formula: C32H38N2O4 MolecularWeight: 514.65512

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)C(=O)OC3=CC4=C(CC(CC4)C(=O)O)C=C3

Isomeric SMILES

CCCCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)C(=O)OC3=CC4=C(CC(CC4)C(=O)O)C=C3

InChI

InChI=1S/C32H38N2O4/c1-2-3-4-5-6-7-8-9-10-23-21-33-30(34-22-23)24-11-13-25(14-12-24)32(37)38-29-18-17-26-19-28(31(35)36)16-15-27(26)20-29/h11-14,17-18,20-22,28H,2-10,15-16,19H2,1H3,(H,35,36)