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

Systemtic Name: octan-2-yl 4-(5-propylpyrazin-2-yl)benzoate Openeye Name: 1-methylheptyl 4-(5-propylpyrazin-2-yl)benzoate CAS Name: 4-(5-propyl-2-pyrazinyl)benzoic acid octan-2-yl ester IUPAC Name: octan-2-yl 4-(5-propylpyrazin-2-yl)benzoate Traditional Name: 4-(5-propylpyrazin-2-yl)benzoic acid 1-methylheptyl ester Formula: C22H30N2O2 MolecularWeight: 354.4858

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H30N2O2/c1-4-6-7-8-10-17(3)26-22(25)19-13-11-18(12-14-19)21-16-23-20(9-5-2)15-24-21/h11-17H,4-10H2,1-3H3