4-[2-(2-octyl-2,3-dihydro-1H-inden-5-yl)pyrimidin-5-yl]phenol

Systemtic Name: 4-[2-(2-octyl-2,3-dihydro-1H-inden-5-yl)pyrimidin-5-yl]phenol Openeye Name: 4-[2-(2-octylindan-5-yl)pyrimidin-5-yl]phenol CAS Name: 4-[2-(2-octyl-2,3-dihydro-1H-inden-5-yl)-5-pyrimidinyl]phenol IUPAC Name: 4-[2-(2-octyl-2,3-dihydro-1H-inden-5-yl)pyrimidin-5-yl]phenol Traditional Name: 4-[2-(2-octylindan-5-yl)pyrimidin-5-yl]phenol Formula: C27H32N2O MolecularWeight: 400.55578

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1CC2=C(C1)C=C(C=C2)C3=NC=C(C=N3)C4=CC=C(C=C4)O

Isomeric SMILES

CCCCCCCCC1CC2=C(C1)C=C(C=C2)C3=NC=C(C=N3)C4=CC=C(C=C4)O

InChI

InChI=1S/C27H32N2O/c1-2-3-4-5-6-7-8-20-15-22-9-10-23(17-24(22)16-20)27-28-18-25(19-29-27)21-11-13-26(30)14-12-21/h9-14,17-20,30H,2-8,15-16H2,1H3