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

Systemtic Name: octan-2-yl 4-(5-butylpyrazin-2-yl)benzoate Openeye Name: 1-methylheptyl 4-(5-butylpyrazin-2-yl)benzoate CAS Name: 4-(5-butyl-2-pyrazinyl)benzoic acid octan-2-yl ester IUPAC Name: octan-2-yl 4-(5-butylpyrazin-2-yl)benzoate Traditional Name: 4-(5-butylpyrazin-2-yl)benzoic acid 1-methylheptyl ester Formula: C23H32N2O2 MolecularWeight: 368.51238

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H32N2O2/c1-4-6-8-9-10-18(3)27-23(26)20-14-12-19(13-15-20)22-17-24-21(16-25-22)11-7-5-2/h12-18H,4-11H2,1-3H3