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

Systemtic Name: (2-chloranylquinolin-3-yl)methyl-(2-methoxyethyl)-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]azanium Openeye Name: (2-chloro-3-quinolyl)methyl-(2-methoxyethyl)-[(4-oxo-1H-quinazolin-2-yl)methyl]ammonium CAS Name: (2-chloro-3-quinolinyl)methyl-(2-methoxyethyl)-[(4-oxo-1H-quinazolin-2-yl)methyl]ammonium IUPAC Name: (2-chloroquinolin-3-yl)methyl-(2-methoxyethyl)-[(4-oxo-1H-quinazolin-2-yl)methyl]azanium Traditional Name: (2-chloro-3-quinolyl)methyl-[(4-keto-1H-quinazolin-2-yl)methyl]-(2-methoxyethyl)ammonium Formula: C22H22ClN4O2+ MolecularWeight: 409.88868

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H21ClN4O2/c1-29-11-10-27(13-16-12-15-6-2-4-8-18(15)25-21(16)23)14-20-24-19-9-5-3-7-17(19)22(28)26-20/h2-9,12H,10-11,13-14H2,1H3,(H,24,26,28)/p+1