ethyl 4-[2-(4,4-dimethyl-2,3-dihydro-1H-quinolin-7-yl)ethynyl]benzoate

Systemtic Name: ethyl 4-[2-(4,4-dimethyl-2,3-dihydro-1H-quinolin-7-yl)ethynyl]benzoate Openeye Name: ethyl 4-[2-(4,4-dimethyl-2,3-dihydro-1H-quinolin-7-yl)ethynyl]benzoate CAS Name: 4-[2-(4,4-dimethyl-2,3-dihydro-1H-quinolin-7-yl)ethynyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[2-(4,4-dimethyl-2,3-dihydro-1H-quinolin-7-yl)ethynyl]benzoate Traditional Name: 4-[2-(4,4-dimethyl-2,3-dihydro-1H-quinolin-7-yl)ethynyl]benzoic acid ethyl ester Formula: C22H23NO2 MolecularWeight: 333.42352

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)C#CC2=CC3=C(C=C2)C(CCN3)(C)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)C#CC2=CC3=C(C=C2)C(CCN3)(C)C

InChI

InChI=1S/C22H23NO2/c1-4-25-21(24)18-10-7-16(8-11-18)5-6-17-9-12-19-20(15-17)23-14-13-22(19,2)3/h7-12,15,23H,4,13-14H2,1-3H3