ethyl (E)-3-[(2-phenylquinolin-4-yl)carbonylamino]but-2-enoate

Systemtic Name: ethyl (E)-3-[(2-phenylquinolin-4-yl)carbonylamino]but-2-enoate Openeye Name: ethyl (E)-3-[(2-phenylquinoline-4-carbonyl)amino]but-2-enoate CAS Name: (E)-3-[[oxo-(2-phenyl-4-quinolinyl)methyl]amino]-2-butenoic acid ethyl ester IUPAC Name: ethyl (E)-3-[(2-phenylquinoline-4-carbonyl)amino]but-2-enoate Traditional Name: (E)-3-[(2-phenylquinoline-4-carbonyl)amino]but-2-enoic acid ethyl ester Formula: C22H20N2O3 MolecularWeight: 360.4058

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=C(C)NC(=O)C1=CC(=NC2=CC=CC=C21)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)/C=C(\C)/NC(=O)C1=CC(=NC2=CC=CC=C21)C3=CC=CC=C3

InChI

InChI=1S/C22H20N2O3/c1-3-27-21(25)13-15(2)23-22(26)18-14-20(16-9-5-4-6-10-16)24-19-12-8-7-11-17(18)19/h4-14H,3H2,1-2H3,(H,23,26)/b15-13+