6-iodanyl-3-(2-nitrophenyl)-2-[(E)-2-pyridin-3-ylethenyl]quinazolin-4-one

Systemtic Name: 6-iodanyl-3-(2-nitrophenyl)-2-[(E)-2-pyridin-3-ylethenyl]quinazolin-4-one Openeye Name: 6-iodo-3-(2-nitrophenyl)-2-[(E)-2-(3-pyridyl)vinyl]quinazolin-4-one CAS Name: 6-iodo-3-(2-nitrophenyl)-2-[(E)-2-(3-pyridinyl)ethenyl]-4-quinazolinone IUPAC Name: 6-iodo-3-(2-nitrophenyl)-2-[(E)-2-pyridin-3-ylethenyl]quinazolin-4-one Traditional Name: 6-iodo-3-(2-nitrophenyl)-2-[(E)-2-(3-pyridyl)vinyl]quinazolin-4-one Formula: C21H13IN4O3 MolecularWeight: 496.25739

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)N2C(=NC3=C(C2=O)C=C(C=C3)I)C=CC4=CN=CC=C4)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C21H13IN4O3/c22-15-8-9-17-16(12-15)21(27)25(18-5-1-2-6-19(18)26(28)29)20(24-17)10-7-14-4-3-11-23-13-14/h1-13H/b10-7+