4-[[4-[(2-ethylquinolin-4-yl)methyl]phenyl]carbonylamino]pyrrolidine-1,3-dicarboxylate

Systemtic Name: 4-[[4-[(2-ethylquinolin-4-yl)methyl]phenyl]carbonylamino]pyrrolidine-1,3-dicarboxylate Openeye Name: 4-[[4-[(2-ethyl-4-quinolyl)methyl]benzoyl]amino]pyrrolidine-1,3-dicarboxylate CAS Name: 4-[[[4-[(2-ethyl-4-quinolinyl)methyl]phenyl]-oxomethyl]amino]pyrrolidine-1,3-dicarboxylate IUPAC Name: 4-[[4-[(2-ethylquinolin-4-yl)methyl]benzoyl]amino]pyrrolidine-1,3-dicarboxylate Traditional Name: 4-[[4-[(2-ethyl-4-quinolyl)methyl]benzoyl]amino]pyrrolidine-1,3-dicarboxylate Formula: C25H23N3O5-2 MolecularWeight: 445.46722

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=CC=CC=C2C(=C1)CC3=CC=C(C=C3)C(=O)NC4CN(CC4C(=O)[O-])C(=O)[O-]

Isomeric SMILES

CCC1=NC2=CC=CC=C2C(=C1)CC3=CC=C(C=C3)C(=O)NC4CN(CC4C(=O)[O-])C(=O)[O-]

InChI

InChI=1S/C25H25N3O5/c1-2-18-12-17(19-5-3-4-6-21(19)26-18)11-15-7-9-16(10-8-15)23(29)27-22-14-28(25(32)33)13-20(22)24(30)31/h3-10,12,20,22H,2,11,13-14H2,1H3,(H,27,29)(H,30,31)(H,32,33)/p-2