(4-propylphenyl) 4-[4-(1-heptoxyethyl)phenyl]benzoate

Systemtic Name: (4-propylphenyl) 4-[4-(1-heptoxyethyl)phenyl]benzoate Openeye Name: (4-propylphenyl) 4-[4-(1-heptoxyethyl)phenyl]benzoate CAS Name: 4-[4-(1-heptoxyethyl)phenyl]benzoic acid (4-propylphenyl) ester IUPAC Name: (4-propylphenyl) 4-[4-(1-heptoxyethyl)phenyl]benzoate Traditional Name: 4-[4-(1-heptoxyethyl)phenyl]benzoic acid (4-propylphenyl) ester Formula: C31H38O3 MolecularWeight: 458.63162

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC(C)C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC3=CC=C(C=C3)CCC

Isomeric SMILES

CCCCCCCOC(C)C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC3=CC=C(C=C3)CCC

InChI

InChI=1S/C31H38O3/c1-4-6-7-8-9-23-33-24(3)26-13-15-27(16-14-26)28-17-19-29(20-18-28)31(32)34-30-21-11-25(10-5-2)12-22-30/h11-22,24H,4-10,23H2,1-3H3