(2-oxidanylidene-1,2-diphenyl-ethyl) 2-ethyl-3-methyl-quinoline-4-carboxylate

Systemtic Name: (2-oxidanylidene-1,2-diphenyl-ethyl) 2-ethyl-3-methyl-quinoline-4-carboxylate Openeye Name: (2-oxo-1,2-diphenyl-ethyl) 2-ethyl-3-methyl-quinoline-4-carboxylate CAS Name: 2-ethyl-3-methyl-4-quinolinecarboxylic acid (2-oxo-1,2-diphenylethyl) ester IUPAC Name: (2-oxo-1,2-diphenylethyl) 2-ethyl-3-methylquinoline-4-carboxylate Traditional Name: 2-ethyl-3-methyl-cinchoninic acid desyl ester Formula: C27H23NO3 MolecularWeight: 409.47642

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=CC=CC=C2C(=C1C)C(=O)OC(C3=CC=CC=C3)C(=O)C4=CC=CC=C4

Isomeric SMILES

CCC1=NC2=CC=CC=C2C(=C1C)C(=O)OC(C3=CC=CC=C3)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C27H23NO3/c1-3-22-18(2)24(21-16-10-11-17-23(21)28-22)27(30)31-26(20-14-8-5-9-15-20)25(29)19-12-6-4-7-13-19/h4-17,26H,3H2,1-2H3