2-chloranylpentylbenzene; 5-pentyl-2-phenyl-pyrimidine

Systemtic Name: 2-chloranylpentylbenzene; 5-pentyl-2-phenyl-pyrimidine Openeye Name: 2-chloropentylbenzene; 5-pentyl-2-phenyl-pyrimidine CAS Name: 2-chloropentylbenzene; 5-pentyl-2-phenylpyrimidine IUPAC Name: 2-chloropentylbenzene; 5-pentyl-2-phenylpyrimidine Traditional Name: 5-amyl-2-phenyl-pyrimidine; 2-chloropentylbenzene Formula: C26H33ClN2 MolecularWeight: 409.00662

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CN=C(N=C1)C2=CC=CC=C2.CCCC(CC1=CC=CC=C1)Cl

Isomeric SMILES

CCCCCC1=CN=C(N=C1)C2=CC=CC=C2.CCCC(CC1=CC=CC=C1)Cl

InChI

InChI=1S/C15H18N2.C11H15Cl/c1-2-3-5-8-13-11-16-15(17-12-13)14-9-6-4-7-10-14;1-2-6-11(12)9-10-7-4-3-5-8-10/h4,6-7,9-12H,2-3,5,8H2,1H3;3-5,7-8,11H,2,6,9H2,1H3