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

Systemtic Name: butyl-[(4-nitrophenyl)methyl]-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]azanium Openeye Name: butyl-[(4-nitrophenyl)methyl]-[(4-oxo-1H-quinazolin-2-yl)methyl]ammonium CAS Name: butyl-[(4-nitrophenyl)methyl]-[(4-oxo-1H-quinazolin-2-yl)methyl]ammonium IUPAC Name: butyl-[(4-nitrophenyl)methyl]-[(4-oxo-1H-quinazolin-2-yl)methyl]azanium Traditional Name: butyl-[(4-keto-1H-quinazolin-2-yl)methyl]-(4-nitrobenzyl)ammonium Formula: C20H23N4O3+ MolecularWeight: 367.42162

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH+](CC1=CC=C(C=C1)[N+](=O)[O-])CC2=NC(=O)C3=CC=CC=C3N2

Isomeric SMILES

CCCC[NH+](CC1=CC=C(C=C1)[N+](=O)[O-])CC2=NC(=O)C3=CC=CC=C3N2

InChI

InChI=1S/C20H22N4O3/c1-2-3-12-23(13-15-8-10-16(11-9-15)24(26)27)14-19-21-18-7-5-4-6-17(18)20(25)22-19/h4-11H,2-3,12-14H2,1H3,(H,21,22,25)/p+1