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

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

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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=CN=CC=C4

Isomeric SMILES

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

InChI

InChI=1S/C22H15IN4O3/c1-14-4-7-17(27(29)30)12-20(14)26-21(9-5-15-3-2-10-24-13-15)25-19-8-6-16(23)11-18(19)22(26)28/h2-13H,1H3/b9-5+