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

Systemtic Name: 6-[4-(5-octoxypyrimidin-2-yl)phenyl]carbonyloxy-1,2,3,4-tetrahydronaphthalene-2-carboxylic acid Openeye Name: 6-[4-(5-octoxypyrimidin-2-yl)benzoyl]oxytetralin-2-carboxylic acid CAS Name: 6-[[4-(5-octoxy-2-pyrimidinyl)phenyl]-oxomethoxy]-1,2,3,4-tetrahydronaphthalene-2-carboxylic acid IUPAC Name: 6-[4-(5-octoxypyrimidin-2-yl)benzoyl]oxy-1,2,3,4-tetrahydronaphthalene-2-carboxylic acid Traditional Name: 6-[4-(5-octoxypyrimidin-2-yl)benzoyl]oxytetralin-2-carboxylic acid Formula: C30H34N2O5 MolecularWeight: 502.60136

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CN=C(N=C1)C2=CC=C(C=C2)C(=O)OC3=CC4=C(CC(CC4)C(=O)O)C=C3

Isomeric SMILES

CCCCCCCCOC1=CN=C(N=C1)C2=CC=C(C=C2)C(=O)OC3=CC4=C(CC(CC4)C(=O)O)C=C3

InChI

InChI=1S/C30H34N2O5/c1-2-3-4-5-6-7-16-36-27-19-31-28(32-20-27)21-8-10-22(11-9-21)30(35)37-26-15-14-23-17-25(29(33)34)13-12-24(23)18-26/h8-11,14-15,18-20,25H,2-7,12-13,16-17H2,1H3,(H,33,34)