6-chloranyl-2-(1-iodanylethyl)-3-oxidanidyl-4-phenyl-quinazolin-3-ium

Systemtic Name: 6-chloranyl-2-(1-iodanylethyl)-3-oxidanidyl-4-phenyl-quinazolin-3-ium Openeye Name: 6-chloro-2-(1-iodoethyl)-3-oxido-4-phenyl-quinazolin-3-ium CAS Name: 6-chloro-2-(1-iodoethyl)-3-oxido-4-phenylquinazolin-3-ium IUPAC Name: 6-chloro-2-(1-iodoethyl)-3-oxido-4-phenylquinazolin-3-ium Traditional Name: 6-chloro-2-(1-iodoethyl)-3-oxido-4-phenyl-quinazolin-3-ium Formula: C16H12ClIN2O MolecularWeight: 410.63675

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC2=C(C=C(C=C2)Cl)C(=[N+]1[O-])C3=CC=CC=C3)I

Isomeric SMILES

CC(C1=NC2=C(C=C(C=C2)Cl)C(=[N+]1[O-])C3=CC=CC=C3)I

InChI

InChI=1S/C16H12ClIN2O/c1-10(18)16-19-14-8-7-12(17)9-13(14)15(20(16)21)11-5-3-2-4-6-11/h2-10H,1H3