3-(6-chloranyl-2-oxidanylidene-4-phenyl-1,4-dihydroquinazolin-3-yl)propyl-trimethyl-azanium iodide

Systemtic Name: 3-(6-chloranyl-2-oxidanylidene-4-phenyl-1,4-dihydroquinazolin-3-yl)propyl-trimethyl-azanium iodide Openeye Name: 3-(6-chloro-2-oxo-4-phenyl-1,4-dihydroquinazolin-3-yl)propyl-trimethyl-ammonium iodide CAS Name: 3-(6-chloro-2-oxo-4-phenyl-1,4-dihydroquinazolin-3-yl)propyl-trimethylammonium iodide IUPAC Name: 3-(6-chloro-2-oxo-4-phenyl-1,4-dihydroquinazolin-3-yl)propyl-trimethylazanium iodide Traditional Name: 3-(6-chloro-2-keto-4-phenyl-1,4-dihydroquinazolin-3-yl)propyl-trimethyl-ammonium iodide Formula: C20H25ClIN3O MolecularWeight: 485.78947

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)CCCN1C(C2=C(C=CC(=C2)Cl)NC1=O)C3=CC=CC=C3.[I-]

Isomeric SMILES

C[N+](C)(C)CCCN1C(C2=C(C=CC(=C2)Cl)NC1=O)C3=CC=CC=C3.[I-]

InChI

InChI=1S/C20H24ClN3O.HI/c1-24(2,3)13-7-12-23-19(15-8-5-4-6-9-15)17-14-16(21)10-11-18(17)22-20(23)25;/h4-6,8-11,14,19H,7,12-13H2,1-3H3;1H