4-[2-[4-(1-propan-2-yloxycyclopropyl)phenyl]ethynyl]benzoic acid

Systemtic Name: 4-[2-[4-(1-propan-2-yloxycyclopropyl)phenyl]ethynyl]benzoic acid Openeye Name: 4-[2-[4-(1-isopropoxycyclopropyl)phenyl]ethynyl]benzoic acid CAS Name: 4-[2-[4-(1-propan-2-yloxycyclopropyl)phenyl]ethynyl]benzoic acid IUPAC Name: 4-[2-[4-(1-propan-2-yloxycyclopropyl)phenyl]ethynyl]benzoic acid Traditional Name: 4-[2-[4-(1-isopropoxycyclopropyl)phenyl]ethynyl]benzoic acid Formula: C21H20O3 MolecularWeight: 320.3817

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1(CC1)C2=CC=C(C=C2)C#CC3=CC=C(C=C3)C(=O)O

Isomeric SMILES

CC(C)OC1(CC1)C2=CC=C(C=C2)C#CC3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C21H20O3/c1-15(2)24-21(13-14-21)19-11-7-17(8-12-19)4-3-16-5-9-18(10-6-16)20(22)23/h5-12,15H,13-14H2,1-2H3,(H,22,23)