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

Systemtic Name: 1-butoxypropan-2-yl 4-(4-heptoxyphenyl)benzoate Openeye Name: (2-butoxy-1-methyl-ethyl) 4-(4-heptoxyphenyl)benzoate CAS Name: 4-(4-heptoxyphenyl)benzoic acid 1-butoxypropan-2-yl ester IUPAC Name: 1-butoxypropan-2-yl 4-(4-heptoxyphenyl)benzoate Traditional Name: 4-(4-heptoxyphenyl)benzoic acid (2-butoxy-1-methyl-ethyl) ester Formula: C27H38O4 MolecularWeight: 426.58822

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC(C)COCCCC

Isomeric SMILES

CCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC(C)COCCCC

InChI

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