[4-[2-[3-tert-butyl-4-(1-ethoxycyclopropyl)phenyl]ethynyl]phenyl] ethanoate

Systemtic Name: [4-[2-[3-tert-butyl-4-(1-ethoxycyclopropyl)phenyl]ethynyl]phenyl] ethanoate Openeye Name: [4-[2-[3-tert-butyl-4-(1-ethoxycyclopropyl)phenyl]ethynyl]phenyl] acetate CAS Name: acetic acid [4-[2-[3-tert-butyl-4-(1-ethoxycyclopropyl)phenyl]ethynyl]phenyl] ester IUPAC Name: [4-[2-[3-tert-butyl-4-(1-ethoxycyclopropyl)phenyl]ethynyl]phenyl] acetate Traditional Name: acetic acid [4-[2-[3-tert-butyl-4-(1-ethoxycyclopropyl)phenyl]ethynyl]phenyl] ester Formula: C25H28O3 MolecularWeight: 376.48802

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1(CC1)C2=C(C=C(C=C2)C#CC3=CC=C(C=C3)OC(=O)C)C(C)(C)C

Isomeric SMILES

CCOC1(CC1)C2=C(C=C(C=C2)C#CC3=CC=C(C=C3)OC(=O)C)C(C)(C)C

InChI

InChI=1S/C25H28O3/c1-6-27-25(15-16-25)22-14-11-20(17-23(22)24(3,4)5)8-7-19-9-12-21(13-10-19)28-18(2)26/h9-14,17H,6,15-16H2,1-5H3