(2-butylphenyl) 4-[4-(1-pentoxyethyl)phenyl]benzoate

Systemtic Name: (2-butylphenyl) 4-[4-(1-pentoxyethyl)phenyl]benzoate Openeye Name: (2-butylphenyl) 4-[4-(1-pentoxyethyl)phenyl]benzoate CAS Name: 4-[4-(1-pentoxyethyl)phenyl]benzoic acid (2-butylphenyl) ester IUPAC Name: (2-butylphenyl) 4-[4-(1-pentoxyethyl)phenyl]benzoate Traditional Name: 4-[4-(1-amoxyethyl)phenyl]benzoic acid (2-butylphenyl) ester Formula: C30H36O3 MolecularWeight: 444.60504

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC(C)C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC3=CC=CC=C3CCCC

Isomeric SMILES

CCCCCOC(C)C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC3=CC=CC=C3CCCC

InChI

InChI=1S/C30H36O3/c1-4-6-10-22-32-23(3)24-14-16-25(17-15-24)26-18-20-28(21-19-26)30(31)33-29-13-9-8-12-27(29)11-7-5-2/h8-9,12-21,23H,4-7,10-11,22H2,1-3H3