nonyl 4-(5-nonylpyrimidin-2-yl)benzoate

Systemtic Name: nonyl 4-(5-nonylpyrimidin-2-yl)benzoate Openeye Name: nonyl 4-(5-nonylpyrimidin-2-yl)benzoate CAS Name: 4-(5-nonyl-2-pyrimidinyl)benzoic acid nonyl ester IUPAC Name: nonyl 4-(5-nonylpyrimidin-2-yl)benzoate Traditional Name: 4-(5-nonylpyrimidin-2-yl)benzoic acid nonyl ester Formula: C29H44N2O2 MolecularWeight: 452.67186

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H44N2O2/c1-3-5-7-9-11-13-15-17-25-23-30-28(31-24-25)26-18-20-27(21-19-26)29(32)33-22-16-14-12-10-8-6-4-2/h18-21,23-24H,3-17,22H2,1-2H3