2-methylbutyl 4-[4-[(E)-dodec-1-enoxy]phenyl]benzoate

Systemtic Name: 2-methylbutyl 4-[4-[(E)-dodec-1-enoxy]phenyl]benzoate Openeye Name: 2-methylbutyl 4-[4-[(E)-dodec-1-enoxy]phenyl]benzoate CAS Name: 4-[4-[(E)-dodec-1-enoxy]phenyl]benzoic acid 2-methylbutyl ester IUPAC Name: 2-methylbutyl 4-[4-[(E)-dodec-1-enoxy]phenyl]benzoate Traditional Name: 4-[4-[(E)-dodec-1-enoxy]phenyl]benzoic acid 2-methylbutyl ester Formula: C30H42O3 MolecularWeight: 450.65268

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC=COC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OCC(C)CC

Isomeric SMILES

CCCCCCCCCC/C=C/OC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OCC(C)CC

InChI

InChI=1S/C30H42O3/c1-4-6-7-8-9-10-11-12-13-14-23-32-29-21-19-27(20-22-29)26-15-17-28(18-16-26)30(31)33-24-25(3)5-2/h14-23,25H,4-13,24H2,1-3H3/b23-14+