butyl-[(6-chloranyl-3-oxidanidyl-4-phenyl-quinazolin-3-ium-2-yl)methyl]-methyl-oxidanyl-azanium

Systemtic Name: butyl-[(6-chloranyl-3-oxidanidyl-4-phenyl-quinazolin-3-ium-2-yl)methyl]-methyl-oxidanyl-azanium Openeye Name: butyl-[(6-chloro-3-oxido-4-phenyl-quinazolin-3-ium-2-yl)methyl]-hydroxy-methyl-ammonium CAS Name: butyl-[(6-chloro-3-oxido-4-phenyl-2-quinazolin-3-iumyl)methyl]-hydroxy-methylammonium IUPAC Name: butyl-[(6-chloro-3-oxido-4-phenylquinazolin-3-ium-2-yl)methyl]-hydroxy-methylazanium Traditional Name: butyl-[(6-chloro-3-oxido-4-phenyl-quinazolin-3-ium-2-yl)methyl]-hydroxy-methyl-ammonium Formula: C20H23ClN3O2+ MolecularWeight: 372.86852

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[N+](C)(CC1=NC2=C(C=C(C=C2)Cl)C(=[N+]1[O-])C3=CC=CC=C3)O

Isomeric SMILES

CCCC[N+](C)(CC1=NC2=C(C=C(C=C2)Cl)C(=[N+]1[O-])C3=CC=CC=C3)O

InChI

InChI=1S/C20H23ClN3O2/c1-3-4-12-24(2,26)14-19-22-18-11-10-16(21)13-17(18)20(23(19)25)15-8-6-5-7-9-15/h5-11,13,26H,3-4,12,14H2,1-2H3/q+1