butyl-[(2-chloranylquinolin-3-yl)methyl]-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]azanium

Systemtic Name: butyl-[(2-chloranylquinolin-3-yl)methyl]-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]azanium Openeye Name: butyl-[(2-chloro-3-quinolyl)methyl]-[(4-oxo-1H-quinazolin-2-yl)methyl]ammonium CAS Name: butyl-[(2-chloro-3-quinolinyl)methyl]-[(4-oxo-1H-quinazolin-2-yl)methyl]ammonium IUPAC Name: butyl-[(2-chloroquinolin-3-yl)methyl]-[(4-oxo-1H-quinazolin-2-yl)methyl]azanium Traditional Name: butyl-[(2-chloro-3-quinolyl)methyl]-[(4-keto-1H-quinazolin-2-yl)methyl]ammonium Formula: C23H24ClN4O+ MolecularWeight: 407.91586

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH+](CC1=CC2=CC=CC=C2N=C1Cl)CC3=NC(=O)C4=CC=CC=C4N3

Isomeric SMILES

CCCC[NH+](CC1=CC2=CC=CC=C2N=C1Cl)CC3=NC(=O)C4=CC=CC=C4N3

InChI

InChI=1S/C23H23ClN4O/c1-2-3-12-28(14-17-13-16-8-4-6-10-19(16)26-22(17)24)15-21-25-20-11-7-5-9-18(20)23(29)27-21/h4-11,13H,2-3,12,14-15H2,1H3,(H,25,27,29)/p+1