2-[(E)-2-(2-morpholin-4-ylquinolin-3-yl)ethenyl]quinoline-4-carboxylate

Systemtic Name: 2-[(E)-2-(2-morpholin-4-ylquinolin-3-yl)ethenyl]quinoline-4-carboxylate Openeye Name: 2-[(E)-2-(2-morpholino-3-quinolyl)vinyl]quinoline-4-carboxylate CAS Name: 2-[(E)-2-[2-(4-morpholinyl)-3-quinolinyl]ethenyl]-4-quinolinecarboxylate IUPAC Name: 2-[(E)-2-(2-morpholin-4-ylquinolin-3-yl)ethenyl]quinoline-4-carboxylate Traditional Name: 2-[(E)-2-(2-morpholino-3-quinolyl)vinyl]cinchoninate Formula: C25H20N3O3- MolecularWeight: 410.4446

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=NC3=CC=CC=C3C=C2C=CC4=NC5=CC=CC=C5C(=C4)C(=O)[O-]

Isomeric SMILES

C1COCCN1C2=NC3=CC=CC=C3C=C2/C=C/C4=NC5=CC=CC=C5C(=C4)C(=O)[O-]

InChI

InChI=1S/C25H21N3O3/c29-25(30)21-16-19(26-23-8-4-2-6-20(21)23)10-9-18-15-17-5-1-3-7-22(17)27-24(18)28-11-13-31-14-12-28/h1-10,15-16H,11-14H2,(H,29,30)/p-1/b10-9+