2-(1,3-benzodioxol-5-yl)-3-(3-ethoxyphenyl)-6-iodanyl-1,2-dihydroquinazolin-4-one

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-3-(3-ethoxyphenyl)-6-iodanyl-1,2-dihydroquinazolin-4-one Openeye Name: 2-(1,3-benzodioxol-5-yl)-3-(3-ethoxyphenyl)-6-iodo-1,2-dihydroquinazolin-4-one CAS Name: 2-(1,3-benzodioxol-5-yl)-3-(3-ethoxyphenyl)-6-iodo-1,2-dihydroquinazolin-4-one IUPAC Name: 2-(1,3-benzodioxol-5-yl)-3-(3-ethoxyphenyl)-6-iodo-1,2-dihydroquinazolin-4-one Traditional Name: 2-(1,3-benzodioxol-5-yl)-6-iodo-3-m-phenetyl-1,2-dihydroquinazolin-4-one Formula: C23H19IN2O4 MolecularWeight: 514.31243

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1)N2C(NC3=C(C2=O)C=C(C=C3)I)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

CCOC1=CC=CC(=C1)N2C(NC3=C(C2=O)C=C(C=C3)I)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C23H19IN2O4/c1-2-28-17-5-3-4-16(12-17)26-22(14-6-9-20-21(10-14)30-13-29-20)25-19-8-7-15(24)11-18(19)23(26)27/h3-12,22,25H,2,13H2,1H3