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

Systemtic Name: 1-[4-(5-dodecylpyrazin-2-yl)phenyl]-3-methyl-pentan-1-one Openeye Name: 1-[4-(5-dodecylpyrazin-2-yl)phenyl]-3-methyl-pentan-1-one CAS Name: 1-[4-(5-dodecyl-2-pyrazinyl)phenyl]-3-methyl-1-pentanone IUPAC Name: 1-[4-(5-dodecylpyrazin-2-yl)phenyl]-3-methylpentan-1-one Traditional Name: 1-[4-(5-laurylpyrazin-2-yl)phenyl]-3-methyl-pentan-1-one Formula: C28H42N2O MolecularWeight: 422.64588

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=NC=C(N=C1)C2=CC=C(C=C2)C(=O)CC(C)CC

Isomeric SMILES

CCCCCCCCCCCCC1=NC=C(N=C1)C2=CC=C(C=C2)C(=O)CC(C)CC

InChI

InChI=1S/C28H42N2O/c1-4-6-7-8-9-10-11-12-13-14-15-26-21-30-27(22-29-26)24-16-18-25(19-17-24)28(31)20-23(3)5-2/h16-19,21-23H,4-15,20H2,1-3H3