(4Z)-2-(4-chlorophenyl)-4-[(2-piperidin-1-ylquinolin-1-ium-3-yl)methylidene]-1,3-oxazol-5-one

Systemtic Name: (4Z)-2-(4-chlorophenyl)-4-[(2-piperidin-1-ylquinolin-1-ium-3-yl)methylidene]-1,3-oxazol-5-one Openeye Name: (4Z)-2-(4-chlorophenyl)-4-[[2-(1-piperidyl)quinolin-1-ium-3-yl]methylene]oxazol-5-one CAS Name: (4Z)-2-(4-chlorophenyl)-4-[[2-(1-piperidinyl)-3-quinolin-1-iumyl]methylidene]-5-oxazolone IUPAC Name: (4Z)-2-(4-chlorophenyl)-4-[(2-piperidin-1-ylquinolin-1-ium-3-yl)methylidene]-1,3-oxazol-5-one Traditional Name: (4Z)-2-(4-chlorophenyl)-4-[(2-piperidinoquinolin-1-ium-3-yl)methylene]-2-oxazolin-5-one Formula: C24H21ClN3O2+ MolecularWeight: 418.89544

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=[NH+]C3=CC=CC=C3C=C2C=C4C(=O)OC(=N4)C5=CC=C(C=C5)Cl

Isomeric SMILES

C1CCN(CC1)C2=[NH+]C3=CC=CC=C3C=C2/C=C\4/C(=O)OC(=N4)C5=CC=C(C=C5)Cl

InChI

InChI=1S/C24H20ClN3O2/c25-19-10-8-16(9-11-19)23-27-21(24(29)30-23)15-18-14-17-6-2-3-7-20(17)26-22(18)28-12-4-1-5-13-28/h2-3,6-11,14-15H,1,4-5,12-13H2/p+1/b21-15-