(2-pentadecylphenyl) 4-(1-methoxyethyl)benzoate

Systemtic Name: (2-pentadecylphenyl) 4-(1-methoxyethyl)benzoate Openeye Name: (2-pentadecylphenyl) 4-(1-methoxyethyl)benzoate CAS Name: 4-(1-methoxyethyl)benzoic acid (2-pentadecylphenyl) ester IUPAC Name: (2-pentadecylphenyl) 4-(1-methoxyethyl)benzoate Traditional Name: 4-(1-methoxyethyl)benzoic acid (2-pentadecylphenyl) ester Formula: C31H46O3 MolecularWeight: 466.69514

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC1=CC=CC=C1OC(=O)C2=CC=C(C=C2)C(C)OC

Isomeric SMILES

CCCCCCCCCCCCCCCC1=CC=CC=C1OC(=O)C2=CC=C(C=C2)C(C)OC

InChI

InChI=1S/C31H46O3/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-19-28-20-17-18-21-30(28)34-31(32)29-24-22-27(23-25-29)26(2)33-3/h17-18,20-26H,4-16,19H2,1-3H3