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

Systemtic Name: (6-chloranyl-3-oxidanidyl-4-phenyl-quinazolin-3-ium-2-yl)methyl-methyl-oxidanyl-propyl-azanium Openeye Name: (6-chloro-3-oxido-4-phenyl-quinazolin-3-ium-2-yl)methyl-hydroxy-methyl-propyl-ammonium CAS Name: (6-chloro-3-oxido-4-phenyl-2-quinazolin-3-iumyl)methyl-hydroxy-methyl-propylammonium IUPAC Name: (6-chloro-3-oxido-4-phenylquinazolin-3-ium-2-yl)methyl-hydroxy-methyl-propylazanium Traditional Name: (6-chloro-3-oxido-4-phenyl-quinazolin-3-ium-2-yl)methyl-hydroxy-methyl-propyl-ammonium Formula: C19H21ClN3O2+ MolecularWeight: 358.84194

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21ClN3O2/c1-3-11-23(2,25)13-18-21-17-10-9-15(20)12-16(17)19(22(18)24)14-7-5-4-6-8-14/h4-10,12,25H,3,11,13H2,1-2H3/q+1