(2Z)-3-methyl-2-[(1-pentylquinolin-1-ium-4-yl)methylidene]-1,3-benzoxazole

Systemtic Name: (2Z)-3-methyl-2-[(1-pentylquinolin-1-ium-4-yl)methylidene]-1,3-benzoxazole Openeye Name: (2Z)-3-methyl-2-[(1-pentylquinolin-1-ium-4-yl)methylene]-1,3-benzoxazole CAS Name: (2Z)-3-methyl-2-[(1-pentyl-4-quinolin-1-iumyl)methylidene]-1,3-benzoxazole IUPAC Name: (2Z)-3-methyl-2-[(1-pentylquinolin-1-ium-4-yl)methylidene]-1,3-benzoxazole Traditional Name: (2Z)-2-[(1-amylquinolin-1-ium-4-yl)methylene]-3-methyl-1,3-benzoxazole Formula: C23H25N2O+ MolecularWeight: 345.4574

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC[N+]1=CC=C(C2=CC=CC=C21)C=C3N(C4=CC=CC=C4O3)C

Isomeric SMILES

CCCCC[N+]1=CC=C(C2=CC=CC=C21)/C=C\3/N(C4=CC=CC=C4O3)C

InChI

InChI=1S/C23H25N2O/c1-3-4-9-15-25-16-14-18(19-10-5-6-11-20(19)25)17-23-24(2)21-12-7-8-13-22(21)26-23/h5-8,10-14,16-17H,3-4,9,15H2,1-2H3/q+1