7-cyclopentylheptyl 4-(5-nonylpyrimidin-2-yl)benzoate

Systemtic Name: 7-cyclopentylheptyl 4-(5-nonylpyrimidin-2-yl)benzoate Openeye Name: 7-cyclopentylheptyl 4-(5-nonylpyrimidin-2-yl)benzoate CAS Name: 4-(5-nonyl-2-pyrimidinyl)benzoic acid 7-cyclopentylheptyl ester IUPAC Name: 7-cyclopentylheptyl 4-(5-nonylpyrimidin-2-yl)benzoate Traditional Name: 4-(5-nonylpyrimidin-2-yl)benzoic acid 7-cyclopentylheptyl ester Formula: C32H48N2O2 MolecularWeight: 492.73572

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)C(=O)OCCCCCCCC3CCCC3

Isomeric SMILES

CCCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)C(=O)OCCCCCCCC3CCCC3

InChI

InChI=1S/C32H48N2O2/c1-2-3-4-5-6-8-12-19-28-25-33-31(34-26-28)29-20-22-30(23-21-29)32(35)36-24-15-10-7-9-11-16-27-17-13-14-18-27/h20-23,25-27H,2-19,24H2,1H3