5-(8-cyclopentyloctyl)-2-[4-[(3-hexyloxiran-2-yl)methoxy]phenyl]pyrimidine

Systemtic Name: 5-(8-cyclopentyloctyl)-2-[4-[(3-hexyloxiran-2-yl)methoxy]phenyl]pyrimidine Openeye Name: 5-(8-cyclopentyloctyl)-2-[4-[(3-hexyloxiran-2-yl)methoxy]phenyl]pyrimidine CAS Name: 5-(8-cyclopentyloctyl)-2-[4-[(3-hexyl-2-oxiranyl)methoxy]phenyl]pyrimidine IUPAC Name: 5-(8-cyclopentyloctyl)-2-[4-[(3-hexyloxiran-2-yl)methoxy]phenyl]pyrimidine Traditional Name: 5-(8-cyclopentyloctyl)-2-[4-[(3-hexyloxiran-2-yl)methoxy]phenyl]pyrimidine Formula: C32H48N2O2 MolecularWeight: 492.73572

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1C(O1)COC2=CC=C(C=C2)C3=NC=C(C=N3)CCCCCCCCC4CCCC4

Isomeric SMILES

CCCCCCC1C(O1)COC2=CC=C(C=C2)C3=NC=C(C=N3)CCCCCCCCC4CCCC4

InChI

InChI=1S/C32H48N2O2/c1-2-3-4-11-18-30-31(36-30)25-35-29-21-19-28(20-22-29)32-33-23-27(24-34-32)17-10-8-6-5-7-9-14-26-15-12-13-16-26/h19-24,26,30-31H,2-18,25H2,1H3