(4E)-4-[(7-methoxy-2-piperidin-1-yl-quinolin-3-yl)methylidene]-2-phenyl-1,3-oxazol-3-ium-5-one

Systemtic Name: (4E)-4-[(7-methoxy-2-piperidin-1-yl-quinolin-3-yl)methylidene]-2-phenyl-1,3-oxazol-3-ium-5-one Openeye Name: (4E)-4-[[7-methoxy-2-(1-piperidyl)-3-quinolyl]methylene]-2-phenyl-oxazol-3-ium-5-one CAS Name: (4E)-4-[[7-methoxy-2-(1-piperidinyl)-3-quinolinyl]methylidene]-2-phenyl-5-oxazol-3-iumone IUPAC Name: (4E)-4-[(7-methoxy-2-piperidin-1-ylquinolin-3-yl)methylidene]-2-phenyl-1,3-oxazol-3-ium-5-one Traditional Name: (4E)-4-[(7-methoxy-2-piperidino-3-quinolyl)methylene]-2-phenyl-2-oxazolin-3-ium-5-one Formula: C25H24N3O3+ MolecularWeight: 414.47636

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=NC(=C(C=C2C=C1)C=C3C(=O)OC(=[NH+]3)C4=CC=CC=C4)N5CCCCC5

Isomeric SMILES

COC1=CC2=NC(=C(C=C2C=C1)/C=C/3\C(=O)OC(=[NH+]3)C4=CC=CC=C4)N5CCCCC5

InChI

InChI=1S/C25H23N3O3/c1-30-20-11-10-18-14-19(23(26-21(18)16-20)28-12-6-3-7-13-28)15-22-25(29)31-24(27-22)17-8-4-2-5-9-17/h2,4-5,8-11,14-16H,3,6-7,12-13H2,1H3/p+1/b22-15+