[4-[2-[4-(1-ethoxycyclopropyl)-3-propan-2-yl-phenyl]ethynyl]phenyl] propanoate

Systemtic Name: [4-[2-[4-(1-ethoxycyclopropyl)-3-propan-2-yl-phenyl]ethynyl]phenyl] propanoate Openeye Name: [4-[2-[4-(1-ethoxycyclopropyl)-3-isopropyl-phenyl]ethynyl]phenyl] propanoate CAS Name: propanoic acid [4-[2-[4-(1-ethoxycyclopropyl)-3-propan-2-ylphenyl]ethynyl]phenyl] ester IUPAC Name: [4-[2-[4-(1-ethoxycyclopropyl)-3-propan-2-ylphenyl]ethynyl]phenyl] propanoate Traditional Name: propionic acid [4-[2-[4-(1-ethoxycyclopropyl)-3-isopropyl-phenyl]ethynyl]phenyl] ester Formula: C25H28O3 MolecularWeight: 376.48802

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OC1=CC=C(C=C1)C#CC2=CC(=C(C=C2)C3(CC3)OCC)C(C)C

Isomeric SMILES

CCC(=O)OC1=CC=C(C=C1)C#CC2=CC(=C(C=C2)C3(CC3)OCC)C(C)C

InChI

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