ethyl 4-[6-(4-methoxyphenyl)hex-3-ynylamino]benzoate

Systemtic Name: ethyl 4-[6-(4-methoxyphenyl)hex-3-ynylamino]benzoate Openeye Name: ethyl 4-[6-(4-methoxyphenyl)hex-3-ynylamino]benzoate CAS Name: 4-[6-(4-methoxyphenyl)hex-3-ynylamino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[6-(4-methoxyphenyl)hex-3-ynylamino]benzoate Traditional Name: 4-[6-(4-methoxyphenyl)hex-3-ynylamino]benzoic acid ethyl ester Formula: C22H25NO3 MolecularWeight: 351.4388

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NCCC#CCCC2=CC=C(C=C2)OC

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NCCC#CCCC2=CC=C(C=C2)OC

InChI

InChI=1S/C22H25NO3/c1-3-26-22(24)19-11-13-20(14-12-19)23-17-7-5-4-6-8-18-9-15-21(25-2)16-10-18/h9-16,23H,3,6-8,17H2,1-2H3