3-[2-(4-iodophenyl)-2-oxidanylidene-ethyl]quinazolin-4-one

Systemtic Name: 3-[2-(4-iodophenyl)-2-oxidanylidene-ethyl]quinazolin-4-one Openeye Name: 3-[2-(4-iodophenyl)-2-oxo-ethyl]quinazolin-4-one CAS Name: 3-[2-(4-iodophenyl)-2-oxoethyl]-4-quinazolinone IUPAC Name: 3-[2-(4-iodophenyl)-2-oxoethyl]quinazolin-4-one Traditional Name: 3-[2-(4-iodophenyl)-2-keto-ethyl]quinazolin-4-one Formula: C16H11IN2O2 MolecularWeight: 390.17521

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C=N2)CC(=O)C3=CC=C(C=C3)I

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C=N2)CC(=O)C3=CC=C(C=C3)I

InChI

InChI=1S/C16H11IN2O2/c17-12-7-5-11(6-8-12)15(20)9-19-10-18-14-4-2-1-3-13(14)16(19)21/h1-8,10H,9H2