octan-2-yl 4-(5-pentylpyrazin-2-yl)benzoate

Systemtic Name: octan-2-yl 4-(5-pentylpyrazin-2-yl)benzoate Openeye Name: 1-methylheptyl 4-(5-pentylpyrazin-2-yl)benzoate CAS Name: 4-(5-pentyl-2-pyrazinyl)benzoic acid octan-2-yl ester IUPAC Name: octan-2-yl 4-(5-pentylpyrazin-2-yl)benzoate Traditional Name: 4-(5-amylpyrazin-2-yl)benzoic acid 1-methylheptyl ester Formula: C24H34N2O2 MolecularWeight: 382.53896

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)OC(=O)C1=CC=C(C=C1)C2=CN=C(C=N2)CCCCC

Isomeric SMILES

CCCCCCC(C)OC(=O)C1=CC=C(C=C1)C2=CN=C(C=N2)CCCCC

InChI

InChI=1S/C24H34N2O2/c1-4-6-8-10-11-19(3)28-24(27)21-15-13-20(14-16-21)23-18-25-22(17-26-23)12-9-7-5-2/h13-19H,4-12H2,1-3H3