[4-[2-[4-(1-methoxycyclopropyl)phenyl]ethynyl]phenyl] ethanoate

Systemtic Name: [4-[2-[4-(1-methoxycyclopropyl)phenyl]ethynyl]phenyl] ethanoate Openeye Name: [4-[2-[4-(1-methoxycyclopropyl)phenyl]ethynyl]phenyl] acetate CAS Name: acetic acid [4-[2-[4-(1-methoxycyclopropyl)phenyl]ethynyl]phenyl] ester IUPAC Name: [4-[2-[4-(1-methoxycyclopropyl)phenyl]ethynyl]phenyl] acetate Traditional Name: acetic acid [4-[2-[4-(1-methoxycyclopropyl)phenyl]ethynyl]phenyl] ester Formula: C20H18O3 MolecularWeight: 306.35512

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H18O3/c1-15(21)23-19-11-7-17(8-12-19)4-3-16-5-9-18(10-6-16)20(22-2)13-14-20/h5-12H,13-14H2,1-2H3