(2-octoxyphenyl) 4-(1-butoxyethyl)benzoate

Systemtic Name: (2-octoxyphenyl) 4-(1-butoxyethyl)benzoate Openeye Name: (2-octoxyphenyl) 4-(1-butoxyethyl)benzoate CAS Name: 4-(1-butoxyethyl)benzoic acid (2-octoxyphenyl) ester IUPAC Name: (2-octoxyphenyl) 4-(1-butoxyethyl)benzoate Traditional Name: 4-(1-butoxyethyl)benzoic acid (2-octoxyphenyl) ester Formula: C27H38O4 MolecularWeight: 426.58822

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=CC=C1OC(=O)C2=CC=C(C=C2)C(C)OCCCC

Isomeric SMILES

CCCCCCCCOC1=CC=CC=C1OC(=O)C2=CC=C(C=C2)C(C)OCCCC

InChI

InChI=1S/C27H38O4/c1-4-6-8-9-10-13-21-30-25-14-11-12-15-26(25)31-27(28)24-18-16-23(17-19-24)22(3)29-20-7-5-2/h11-12,14-19,22H,4-10,13,20-21H2,1-3H3