2-[4-[(4S)-4-methylhexoxy]phenyl]-5-nonyl-pyrimidine

Systemtic Name: 2-[4-[(4S)-4-methylhexoxy]phenyl]-5-nonyl-pyrimidine Openeye Name: 2-[4-[(4S)-4-methylhexoxy]phenyl]-5-nonyl-pyrimidine CAS Name: 2-[4-[(4S)-4-methylhexoxy]phenyl]-5-nonylpyrimidine IUPAC Name: 2-[4-[(4S)-4-methylhexoxy]phenyl]-5-nonylpyrimidine Traditional Name: 2-[4-[(4S)-4-methylhexoxy]phenyl]-5-nonyl-pyrimidine Formula: C26H40N2O MolecularWeight: 396.6086

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)OCCCC(C)CC

Isomeric SMILES

CCCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)OCCC[C@@H](C)CC

InChI

InChI=1S/C26H40N2O/c1-4-6-7-8-9-10-11-14-23-20-27-26(28-21-23)24-15-17-25(18-16-24)29-19-12-13-22(3)5-2/h15-18,20-22H,4-14,19H2,1-3H3/t22-/m0/s1