7-methyl-8-phenyl-5-propan-2-yl-7H-[1,3]dioxolo[4,5-g]quinazoline-5,7-diium-6-one iodide

Systemtic Name: 7-methyl-8-phenyl-5-propan-2-yl-7H-[1,3]dioxolo[4,5-g]quinazoline-5,7-diium-6-one iodide Openeye Name: 5-isopropyl-7-methyl-8-phenyl-7H-[1,3]dioxolo[4,5-g]quinazoline-5,7-diium-6-one iodide CAS Name: 7-methyl-8-phenyl-5-propan-2-yl-7H-[1,3]dioxolo[4,5-g]quinazoline-5,7-diium-6-one iodide IUPAC Name: 7-methyl-8-phenyl-5-propan-2-yl-7H-[1,3]dioxolo[4,5-g]quinazoline-5,7-diium-6-one iodide Traditional Name: 5-isopropyl-7-methyl-8-phenyl-7H-[1,3]dioxolo[4,5-g]quinazoline-5,7-diium-6-one iodide Formula: C19H20IN2O3+ MolecularWeight: 451.27817

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[N+]1=C2C=C3C(=CC2=C([NH+](C1=O)C)C4=CC=CC=C4)OCO3.[I-]

Isomeric SMILES

CC(C)[N+]1=C2C=C3C(=CC2=C([NH+](C1=O)C)C4=CC=CC=C4)OCO3.[I-]

InChI

InChI=1S/C19H19N2O3.HI/c1-12(2)21-15-10-17-16(23-11-24-17)9-14(15)18(20(3)19(21)22)13-7-5-4-6-8-13;/h4-10,12H,11H2,1-3H3;1H/q+1;