[3-[[2-[(3-ethynylphenoxy)methyl]morpholin-4-yl]methyl]phenyl] ethanoate

Systemtic Name: [3-[[2-[(3-ethynylphenoxy)methyl]morpholin-4-yl]methyl]phenyl] ethanoate Openeye Name: [3-[[2-[(3-ethynylphenoxy)methyl]morpholin-4-yl]methyl]phenyl] acetate CAS Name: acetic acid [3-[[2-[(3-ethynylphenoxy)methyl]-4-morpholinyl]methyl]phenyl] ester IUPAC Name: [3-[[2-[(3-ethynylphenoxy)methyl]morpholin-4-yl]methyl]phenyl] acetate Traditional Name: acetic acid [3-[[2-[(3-ethynylphenoxy)methyl]morpholino]methyl]phenyl] ester Formula: C22H23NO4 MolecularWeight: 365.42232

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC=CC(=C1)CN2CCOC(C2)COC3=CC=CC(=C3)C#C

Isomeric SMILES

CC(=O)OC1=CC=CC(=C1)CN2CCOC(C2)COC3=CC=CC(=C3)C#C

InChI

InChI=1S/C22H23NO4/c1-3-18-6-4-8-20(12-18)26-16-22-15-23(10-11-25-22)14-19-7-5-9-21(13-19)27-17(2)24/h1,4-9,12-13,22H,10-11,14-16H2,2H3