[6-(5-oxidanylpyrimidin-2-yl)naphthalen-2-yl] 4-(2-hexoxyethoxy)benzoate

Systemtic Name: [6-(5-oxidanylpyrimidin-2-yl)naphthalen-2-yl] 4-(2-hexoxyethoxy)benzoate Openeye Name: [6-(5-hydroxypyrimidin-2-yl)-2-naphthyl] 4-(2-hexoxyethoxy)benzoate CAS Name: 4-(2-hexoxyethoxy)benzoic acid [6-(5-hydroxy-2-pyrimidinyl)-2-naphthalenyl] ester IUPAC Name: [6-(5-hydroxypyrimidin-2-yl)naphthalen-2-yl] 4-(2-hexoxyethoxy)benzoate Traditional Name: 4-(2-hexoxyethoxy)benzoic acid [6-(5-hydroxypyrimidin-2-yl)-2-naphthyl] ester Formula: C29H30N2O5 MolecularWeight: 486.5589

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOCCOC1=CC=C(C=C1)C(=O)OC2=CC3=C(C=C2)C=C(C=C3)C4=NC=C(C=N4)O

Isomeric SMILES

CCCCCCOCCOC1=CC=C(C=C1)C(=O)OC2=CC3=C(C=C2)C=C(C=C3)C4=NC=C(C=N4)O

InChI

InChI=1S/C29H30N2O5/c1-2-3-4-5-14-34-15-16-35-26-11-8-21(9-12-26)29(33)36-27-13-10-22-17-24(7-6-23(22)18-27)28-30-19-25(32)20-31-28/h6-13,17-20,32H,2-5,14-16H2,1H3