ethyl 3-[4-(cyclobutylmethylamino)phenyl]prop-2-ynoate

Systemtic Name: ethyl 3-[4-(cyclobutylmethylamino)phenyl]prop-2-ynoate Openeye Name: ethyl 3-[4-(cyclobutylmethylamino)phenyl]prop-2-ynoate CAS Name: 3-[4-(cyclobutylmethylamino)phenyl]-2-propynoic acid ethyl ester IUPAC Name: ethyl 3-[4-(cyclobutylmethylamino)phenyl]prop-2-ynoate Traditional Name: 3-[4-(cyclobutylmethylamino)phenyl]propiolic acid ethyl ester Formula: C16H19NO2 MolecularWeight: 257.32756

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C#CC1=CC=C(C=C1)NCC2CCC2

Isomeric SMILES

CCOC(=O)C#CC1=CC=C(C=C1)NCC2CCC2

InChI

InChI=1S/C16H19NO2/c1-2-19-16(18)11-8-13-6-9-15(10-7-13)17-12-14-4-3-5-14/h6-7,9-10,14,17H,2-5,12H2,1H3