[1-oxidanylidene-1-[(4-phenoxyphenyl)amino]propan-2-yl] 3-ethyl-2-propyl-quinoline-4-carboxylate

Systemtic Name: [1-oxidanylidene-1-[(4-phenoxyphenyl)amino]propan-2-yl] 3-ethyl-2-propyl-quinoline-4-carboxylate Openeye Name: [1-methyl-2-oxo-2-(4-phenoxyanilino)ethyl] 3-ethyl-2-propyl-quinoline-4-carboxylate CAS Name: 3-ethyl-2-propyl-4-quinolinecarboxylic acid [1-oxo-1-(4-phenoxyanilino)propan-2-yl] ester IUPAC Name: [1-oxo-1-(4-phenoxyanilino)propan-2-yl] 3-ethyl-2-propylquinoline-4-carboxylate Traditional Name: 3-ethyl-2-propyl-cinchoninic acid [2-keto-1-methyl-2-(4-phenoxyanilino)ethyl] ester Formula: C30H30N2O4 MolecularWeight: 482.5702

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC2=CC=CC=C2C(=C1CC)C(=O)OC(C)C(=O)NC3=CC=C(C=C3)OC4=CC=CC=C4

Isomeric SMILES

CCCC1=NC2=CC=CC=C2C(=C1CC)C(=O)OC(C)C(=O)NC3=CC=C(C=C3)OC4=CC=CC=C4

InChI

InChI=1S/C30H30N2O4/c1-4-11-26-24(5-2)28(25-14-9-10-15-27(25)32-26)30(34)35-20(3)29(33)31-21-16-18-23(19-17-21)36-22-12-7-6-8-13-22/h6-10,12-20H,4-5,11H2,1-3H3,(H,31,33)