(4-oxidanylidene-1H-quinazolin-2-yl)methyl 3-iodanylbenzoate

Systemtic Name: (4-oxidanylidene-1H-quinazolin-2-yl)methyl 3-iodanylbenzoate Openeye Name: (4-oxo-1H-quinazolin-2-yl)methyl 3-iodobenzoate CAS Name: 3-iodobenzoic acid (4-oxo-1H-quinazolin-2-yl)methyl ester IUPAC Name: (4-oxo-1H-quinazolin-2-yl)methyl 3-iodobenzoate Traditional Name: 3-iodobenzoic acid (4-keto-1H-quinazolin-2-yl)methyl ester Formula: C16H11IN2O3 MolecularWeight: 406.17461

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H11IN2O3/c17-11-5-3-4-10(8-11)16(21)22-9-14-18-13-7-2-1-6-12(13)15(20)19-14/h1-8H,9H2,(H,18,19,20)