[4-(5-nonoxypyrimidin-2-yl)phenyl] 5-hexylthiophene-2-carboxylate

Systemtic Name: [4-(5-nonoxypyrimidin-2-yl)phenyl] 5-hexylthiophene-2-carboxylate Openeye Name: [4-(5-nonoxypyrimidin-2-yl)phenyl] 5-hexylthiophene-2-carboxylate CAS Name: 5-hexyl-2-thiophenecarboxylic acid [4-(5-nonoxy-2-pyrimidinyl)phenyl] ester IUPAC Name: [4-(5-nonoxypyrimidin-2-yl)phenyl] 5-hexylthiophene-2-carboxylate Traditional Name: 5-hexylthiophene-2-carboxylic acid [4-(5-nonoxypyrimidin-2-yl)phenyl] ester Formula: C30H40N2O3S MolecularWeight: 508.7152

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCOC1=CN=C(N=C1)C2=CC=C(C=C2)OC(=O)C3=CC=C(S3)CCCCCC

Isomeric SMILES

CCCCCCCCCOC1=CN=C(N=C1)C2=CC=C(C=C2)OC(=O)C3=CC=C(S3)CCCCCC

InChI

InChI=1S/C30H40N2O3S/c1-3-5-7-9-10-11-13-21-34-26-22-31-29(32-23-26)24-15-17-25(18-16-24)35-30(33)28-20-19-27(36-28)14-12-8-6-4-2/h15-20,22-23H,3-14,21H2,1-2H3