2-(1,3-benzodioxol-5-yl)-3-(4-iodophenyl)-1,2-dihydroquinazolin-4-one

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-3-(4-iodophenyl)-1,2-dihydroquinazolin-4-one Openeye Name: 2-(1,3-benzodioxol-5-yl)-3-(4-iodophenyl)-1,2-dihydroquinazolin-4-one CAS Name: 2-(1,3-benzodioxol-5-yl)-3-(4-iodophenyl)-1,2-dihydroquinazolin-4-one IUPAC Name: 2-(1,3-benzodioxol-5-yl)-3-(4-iodophenyl)-1,2-dihydroquinazolin-4-one Traditional Name: 2-(1,3-benzodioxol-5-yl)-3-(4-iodophenyl)-1,2-dihydroquinazolin-4-one Formula: C21H15IN2O3 MolecularWeight: 470.25987

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C3NC4=CC=CC=C4C(=O)N3C5=CC=C(C=C5)I

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C3NC4=CC=CC=C4C(=O)N3C5=CC=C(C=C5)I

InChI

InChI=1S/C21H15IN2O3/c22-14-6-8-15(9-7-14)24-20(13-5-10-18-19(11-13)27-12-26-18)23-17-4-2-1-3-16(17)21(24)25/h1-11,20,23H,12H2