1-[4-(5-hexylpyrazin-2-yl)phenyl]-3-methyl-pentan-1-one

Systemtic Name: 1-[4-(5-hexylpyrazin-2-yl)phenyl]-3-methyl-pentan-1-one Openeye Name: 1-[4-(5-hexylpyrazin-2-yl)phenyl]-3-methyl-pentan-1-one CAS Name: 1-[4-(5-hexyl-2-pyrazinyl)phenyl]-3-methyl-1-pentanone IUPAC Name: 1-[4-(5-hexylpyrazin-2-yl)phenyl]-3-methylpentan-1-one Traditional Name: 1-[4-(5-hexylpyrazin-2-yl)phenyl]-3-methyl-pentan-1-one Formula: C22H30N2O MolecularWeight: 338.4864

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=NC=C(N=C1)C2=CC=C(C=C2)C(=O)CC(C)CC

Isomeric SMILES

CCCCCCC1=NC=C(N=C1)C2=CC=C(C=C2)C(=O)CC(C)CC

InChI

InChI=1S/C22H30N2O/c1-4-6-7-8-9-20-15-24-21(16-23-20)18-10-12-19(13-11-18)22(25)14-17(3)5-2/h10-13,15-17H,4-9,14H2,1-3H3