2-[3-pentyl-4-(3-pentylphenoxy)phenyl]aniline

Systemtic Name: 2-[3-pentyl-4-(3-pentylphenoxy)phenyl]aniline Openeye Name: 2-[3-pentyl-4-(3-pentylphenoxy)phenyl]aniline CAS Name: 2-[3-pentyl-4-(3-pentylphenoxy)phenyl]aniline IUPAC Name: 2-[3-pentyl-4-(3-pentylphenoxy)phenyl]aniline Traditional Name: [2-[3-amyl-4-(3-amylphenoxy)phenyl]phenyl]amine Formula: C28H35NO MolecularWeight: 401.5836

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC(=CC=C1)OC2=C(C=C(C=C2)C3=CC=CC=C3N)CCCCC

Isomeric SMILES

CCCCCC1=CC(=CC=C1)OC2=C(C=C(C=C2)C3=CC=CC=C3N)CCCCC

InChI

InChI=1S/C28H35NO/c1-3-5-7-12-22-13-11-15-25(20-22)30-28-19-18-23(21-24(28)14-8-6-4-2)26-16-9-10-17-27(26)29/h9-11,13,15-21H,3-8,12,14,29H2,1-2H3