2-[1-(2-chloranyldecyl)-4-phenyl-cyclohexa-2,5-dien-1-yl]-5-nonoxy-pyrimidine

Systemtic Name: 2-[1-(2-chloranyldecyl)-4-phenyl-cyclohexa-2,5-dien-1-yl]-5-nonoxy-pyrimidine Openeye Name: 2-[1-(2-chlorodecyl)-4-phenyl-cyclohexa-2,5-dien-1-yl]-5-nonoxy-pyrimidine CAS Name: 2-[1-(2-chlorodecyl)-4-phenyl-1-cyclohexa-2,5-dienyl]-5-nonoxypyrimidine IUPAC Name: 2-[1-(2-chlorodecyl)-4-phenylcyclohexa-2,5-dien-1-yl]-5-nonoxypyrimidine Traditional Name: 2-[1-(2-chlorodecyl)-4-phenyl-cyclohexa-2,5-dien-1-yl]-5-nonoxy-pyrimidine Formula: C35H51ClN2O MolecularWeight: 551.24524

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCOC1=CN=C(N=C1)C2(C=CC(C=C2)C3=CC=CC=C3)CC(CCCCCCCC)Cl

Isomeric SMILES

CCCCCCCCCOC1=CN=C(N=C1)C2(C=CC(C=C2)C3=CC=CC=C3)CC(CCCCCCCC)Cl

InChI

InChI=1S/C35H51ClN2O/c1-3-5-7-9-11-13-18-26-39-33-28-37-34(38-29-33)35(27-32(36)21-17-12-10-8-6-4-2)24-22-31(23-25-35)30-19-15-14-16-20-30/h14-16,19-20,22-25,28-29,31-32H,3-13,17-18,21,26-27H2,1-2H3