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

Systemtic Name: butyl-[(2-cyanophenyl)methyl]-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]azanium Openeye Name: butyl-[(2-cyanophenyl)methyl]-[(4-oxo-1H-quinazolin-2-yl)methyl]ammonium CAS Name: butyl-[(2-cyanophenyl)methyl]-[(4-oxo-1H-quinazolin-2-yl)methyl]ammonium IUPAC Name: butyl-[(2-cyanophenyl)methyl]-[(4-oxo-1H-quinazolin-2-yl)methyl]azanium Traditional Name: butyl-(2-cyanobenzyl)-[(4-keto-1H-quinazolin-2-yl)methyl]ammonium Formula: C21H23N4O+ MolecularWeight: 347.43352

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH+](CC1=CC=CC=C1C#N)CC2=NC(=O)C3=CC=CC=C3N2

Isomeric SMILES

CCCC[NH+](CC1=CC=CC=C1C#N)CC2=NC(=O)C3=CC=CC=C3N2

InChI

InChI=1S/C21H22N4O/c1-2-3-12-25(14-17-9-5-4-8-16(17)13-22)15-20-23-19-11-7-6-10-18(19)21(26)24-20/h4-11H,2-3,12,14-15H2,1H3,(H,23,24,26)/p+1