(7,8-dimethyl-2-oxidanylidene-chromen-4-yl)methyl 2-ethyl-3-methyl-quinoline-4-carboxylate

Systemtic Name: (7,8-dimethyl-2-oxidanylidene-chromen-4-yl)methyl 2-ethyl-3-methyl-quinoline-4-carboxylate Openeye Name: (7,8-dimethyl-2-oxo-chromen-4-yl)methyl 2-ethyl-3-methyl-quinoline-4-carboxylate CAS Name: 2-ethyl-3-methyl-4-quinolinecarboxylic acid (7,8-dimethyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7,8-dimethyl-2-oxochromen-4-yl)methyl 2-ethyl-3-methylquinoline-4-carboxylate Traditional Name: 2-ethyl-3-methyl-cinchoninic acid (2-keto-7,8-dimethyl-chromen-4-yl)methyl ester Formula: C25H23NO4 MolecularWeight: 401.45442

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=CC=CC=C2C(=C1C)C(=O)OCC3=CC(=O)OC4=C3C=CC(=C4C)C

Isomeric SMILES

CCC1=NC2=CC=CC=C2C(=C1C)C(=O)OCC3=CC(=O)OC4=C3C=CC(=C4C)C

InChI

InChI=1S/C25H23NO4/c1-5-20-16(4)23(19-8-6-7-9-21(19)26-20)25(28)29-13-17-12-22(27)30-24-15(3)14(2)10-11-18(17)24/h6-12H,5,13H2,1-4H3