ethyl 3-[[ethyl(2-pyridin-4-ylethyl)amino]methyl]-4-oxidanylidene-1H-quinoline-2-carboxylate

Systemtic Name: ethyl 3-[[ethyl(2-pyridin-4-ylethyl)amino]methyl]-4-oxidanylidene-1H-quinoline-2-carboxylate Openeye Name: ethyl 3-[[ethyl-[2-(4-pyridyl)ethyl]amino]methyl]-4-oxo-1H-quinoline-2-carboxylate CAS Name: 3-[[ethyl(2-pyridin-4-ylethyl)amino]methyl]-4-oxo-1H-quinoline-2-carboxylic acid ethyl ester IUPAC Name: ethyl 3-[[ethyl(2-pyridin-4-ylethyl)amino]methyl]-4-oxo-1H-quinoline-2-carboxylate Traditional Name: 3-[[ethyl-[2-(4-pyridyl)ethyl]amino]methyl]-4-keto-1H-quinoline-2-carboxylic acid ethyl ester Formula: C22H25N3O3 MolecularWeight: 379.4522

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CCC1=CC=NC=C1)CC2=C(NC3=CC=CC=C3C2=O)C(=O)OCC

Isomeric SMILES

CCN(CCC1=CC=NC=C1)CC2=C(NC3=CC=CC=C3C2=O)C(=O)OCC

InChI

InChI=1S/C22H25N3O3/c1-3-25(14-11-16-9-12-23-13-10-16)15-18-20(22(27)28-4-2)24-19-8-6-5-7-17(19)21(18)26/h5-10,12-13H,3-4,11,14-15H2,1-2H3,(H,24,26)