2-[1-(2-methylbutoxy)-4-phenyl-cyclohexa-2,5-dien-1-yl]-5-pentyl-pyrimidine

Systemtic Name: 2-[1-(2-methylbutoxy)-4-phenyl-cyclohexa-2,5-dien-1-yl]-5-pentyl-pyrimidine Openeye Name: 2-[1-(2-methylbutoxy)-4-phenyl-cyclohexa-2,5-dien-1-yl]-5-pentyl-pyrimidine CAS Name: 2-[1-(2-methylbutoxy)-4-phenyl-1-cyclohexa-2,5-dienyl]-5-pentylpyrimidine IUPAC Name: 2-[1-(2-methylbutoxy)-4-phenylcyclohexa-2,5-dien-1-yl]-5-pentylpyrimidine Traditional Name: 5-amyl-2-[1-(2-methylbutoxy)-4-phenyl-cyclohexa-2,5-dien-1-yl]pyrimidine Formula: C26H34N2O MolecularWeight: 390.56096

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CN=C(N=C1)C2(C=CC(C=C2)C3=CC=CC=C3)OCC(C)CC

Isomeric SMILES

CCCCCC1=CN=C(N=C1)C2(C=CC(C=C2)C3=CC=CC=C3)OCC(C)CC

InChI

InChI=1S/C26H34N2O/c1-4-6-8-11-22-18-27-25(28-19-22)26(29-20-21(3)5-2)16-14-24(15-17-26)23-12-9-7-10-13-23/h7,9-10,12-19,21,24H,4-6,8,11,20H2,1-3H3