1-butoxypropan-2-yl 4-(4-nonylphenyl)benzoate

Systemtic Name: 1-butoxypropan-2-yl 4-(4-nonylphenyl)benzoate Openeye Name: (2-butoxy-1-methyl-ethyl) 4-(4-nonylphenyl)benzoate CAS Name: 4-(4-nonylphenyl)benzoic acid 1-butoxypropan-2-yl ester IUPAC Name: 1-butoxypropan-2-yl 4-(4-nonylphenyl)benzoate Traditional Name: 4-(4-nonylphenyl)benzoic acid (2-butoxy-1-methyl-ethyl) ester Formula: C29H42O3 MolecularWeight: 438.64198

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC(C)COCCCC

Isomeric SMILES

CCCCCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC(C)COCCCC

InChI

InChI=1S/C29H42O3/c1-4-6-8-9-10-11-12-13-25-14-16-26(17-15-25)27-18-20-28(21-19-27)29(30)32-24(3)23-31-22-7-5-2/h14-21,24H,4-13,22-23H2,1-3H3