[2-oxidanylidene-2-[[2-(2-oxidanylidenepyrrolidin-1-yl)phenyl]amino]ethyl] 2-propan-2-ylquinoline-4-carboxylate

Systemtic Name: [2-oxidanylidene-2-[[2-(2-oxidanylidenepyrrolidin-1-yl)phenyl]amino]ethyl] 2-propan-2-ylquinoline-4-carboxylate Openeye Name: [2-oxo-2-[2-(2-oxopyrrolidin-1-yl)anilino]ethyl] 2-isopropylquinoline-4-carboxylate CAS Name: 2-propan-2-yl-4-quinolinecarboxylic acid [2-oxo-2-[2-(2-oxo-1-pyrrolidinyl)anilino]ethyl] ester IUPAC Name: [2-oxo-2-[2-(2-oxopyrrolidin-1-yl)anilino]ethyl] 2-propan-2-ylquinoline-4-carboxylate Traditional Name: 2-isopropylcinchoninic acid [2-keto-2-[2-(2-ketopyrrolidino)anilino]ethyl] ester Formula: C25H25N3O4 MolecularWeight: 431.4837

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC2=CC=CC=C2C(=C1)C(=O)OCC(=O)NC3=CC=CC=C3N4CCCC4=O

Isomeric SMILES

CC(C)C1=NC2=CC=CC=C2C(=C1)C(=O)OCC(=O)NC3=CC=CC=C3N4CCCC4=O

InChI

InChI=1S/C25H25N3O4/c1-16(2)21-14-18(17-8-3-4-9-19(17)26-21)25(31)32-15-23(29)27-20-10-5-6-11-22(20)28-13-7-12-24(28)30/h3-6,8-11,14,16H,7,12-13,15H2,1-2H3,(H,27,29)