6-iodanyl-3-(2-methyl-5-nitro-phenyl)-2-[(E)-2-pyridin-2-ylethenyl]quinazolin-4-one

Systemtic Name: 6-iodanyl-3-(2-methyl-5-nitro-phenyl)-2-[(E)-2-pyridin-2-ylethenyl]quinazolin-4-one Openeye Name: 6-iodo-3-(2-methyl-5-nitro-phenyl)-2-[(E)-2-(2-pyridyl)vinyl]quinazolin-4-one CAS Name: 6-iodo-3-(2-methyl-5-nitrophenyl)-2-[(E)-2-(2-pyridinyl)ethenyl]-4-quinazolinone IUPAC Name: 6-iodo-3-(2-methyl-5-nitrophenyl)-2-[(E)-2-pyridin-2-ylethenyl]quinazolin-4-one Traditional Name: 6-iodo-3-(2-methyl-5-nitro-phenyl)-2-[(E)-2-(2-pyridyl)vinyl]quinazolin-4-one Formula: C22H15IN4O3 MolecularWeight: 510.28397

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])N2C(=NC3=C(C2=O)C=C(C=C3)I)C=CC4=CC=CC=N4

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])N2C(=NC3=C(C2=O)C=C(C=C3)I)/C=C/C4=CC=CC=N4

InChI

InChI=1S/C22H15IN4O3/c1-14-5-8-17(27(29)30)13-20(14)26-21(10-7-16-4-2-3-11-24-16)25-19-9-6-15(23)12-18(19)22(26)28/h2-13H,1H3/b10-7+