6-iodanyl-3-(3-methylphenyl)-2-[(E)-2-(5-nitrofuran-2-yl)ethenyl]quinazolin-4-one

Systemtic Name: 6-iodanyl-3-(3-methylphenyl)-2-[(E)-2-(5-nitrofuran-2-yl)ethenyl]quinazolin-4-one Openeye Name: 6-iodo-3-(m-tolyl)-2-[(E)-2-(5-nitro-2-furyl)vinyl]quinazolin-4-one CAS Name: 6-iodo-3-(3-methylphenyl)-2-[(E)-2-(5-nitro-2-furanyl)ethenyl]-4-quinazolinone IUPAC Name: 6-iodo-3-(3-methylphenyl)-2-[(E)-2-(5-nitrofuran-2-yl)ethenyl]quinazolin-4-one Traditional Name: 6-iodo-3-(m-tolyl)-2-[(E)-2-(5-nitro-2-furyl)vinyl]quinazolin-4-one Formula: C21H14IN3O4 MolecularWeight: 499.25803

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=NC3=C(C2=O)C=C(C=C3)I)C=CC4=CC=C(O4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=NC3=C(C2=O)C=C(C=C3)I)/C=C/C4=CC=C(O4)[N+](=O)[O-]

InChI

InChI=1S/C21H14IN3O4/c1-13-3-2-4-15(11-13)24-19(9-6-16-7-10-20(29-16)25(27)28)23-18-8-5-14(22)12-17(18)21(24)26/h2-12H,1H3/b9-6+